UCSF

ZINC38174297

Substance Information

In ZINC since Heavy atoms Benign functionality
January 9th, 2010 8 Yes

Other Names:

"(1R,2R)-(-)-1,2-Diaminocyclohexane, 98% [ee: 99%]"

"(1R,2R)-(-)-1,2-Diaminocyclohexane, 98% [ee: 99.8%]"

((1,2-Cyclohexanediamine-N,N')platinum)di-mu-oxodioxomanganese stereoisomer; LS-89209; Manganato-trans-(-)-1,2-diaminocyclohexaneplatinum(II); Manganese, ((1,2-cyclohexanediamine-N,N')platinum)di-mu-oxodioxo-, stereoisomer

(+/-)-trans-1,2-Cyclohexanediamine

(+/-)-trans-1,2-Diaminocyclohexane

(+/-)-trans-1,2-Diaminocyclohexane, 99%

(1,2-Diaminocyclohexane)platinum(ii) chloride

(1R)-(-)-TRANS-1,2-DIAMINOCYCLOHEXANE

(1R)-trans-1,2-Cyclohexanediamine

(1R)-Trans-1,2-diaminocyclohexane

(1R,2R)-(-)- 1,2-Diaminocyclohexane

(1R,2R)-(-)-1,2-Cyclohexanediamine

(1R,2R)-(-)-1,2-Diaminocyclohexane, 98%

(1R,2R)-(-)-1,2-Diaminocyclohexane, 99%

(1R,2R)-(-)-1,2-Diaminocyclohexane, 99%+

(1R,2R)-1,2-Diaminocyclohexane

(1R,2R)-Cyclohexane-1,2-diamine

(1R,2S)-Cyclohexane-1,2-diamine dihydrochloride

(±)-trans-1,2-Diaminocyclohexane, 98%

(E,E)-3,7,11-Trimethyl-2,6,10-dodecatrien-1-ol

(R,R)-(-)-1,2-Diaminocyclohexane

(R,r)-(-)-1,2-diaminocyclohexane hydrochloride

(R,R)-(-)-1,2-Diaminocyclohexanehydrochloride

(^+)-trans-1,2-Cyclohexanediamine

(¡À)-trans-1,2-Diaminocyclohexane

(±)-trans-1,2-Cyclohexanediamine

-1,2-Diaminocyclohexane

1,2-Cyclohexanediamine; 1,2-Cylohexanediamine; 1,2-Diaminocyclohexane; BRN 0506142; Cyclohex-1,2-ylenediamine; EINECS 211-776-7; HSDB 5748; LS-56758

1,2-Diaminocyclohexane

1,2-Diaminocyclohexane, 99%, mixture of cis and trans

1,2-Diaminocyclohexane, mixture of isomers

1,2-Diaminocyclohexane, mixture of isomers, 99%

61825-94-3; D01790; Eloxatin (TN); Oxaliplatin (JAN/USAN/INN)

62816-98-2; D05272; Ormaplatin (USAN/INN)

CHEMBL1201055

CID9887054

cis-1,2-CyclohexanediaMine

Cis-1,2-Diaminocyclohexane

Cyclohexane-1,2-diamine

Cyclohexane-1,2-diamine 2-cyanoacrylate

D01790

DAP000062

Dichloro(1,2-diaminocyclohexane)platinum(II)

Eloxatin

Eloxatin (TN)

LS-117720; Platinum (II), bis(methylammine)dichloro-, trans-; Platinum (II), dichlorobis(methylamine)-, trans-; trans-Bis(methylammine)dichloroplatinum(II); trans-Dichlorobis(methylammine)platinum(II)

MFCD00001491

MFCD00058826

MFCD00062985

MFCD00063747

MFCD00866327

MFCD01780448

MFCD09037958

Neo-SHP

Not available

OR-2249

Oxaliplatin

Oxaliplatin (Eloxatin)

Oxaliplatin (JAN/USAN/INN)

SS-3134

trans(-)-DDCP

trans,trans-3,7,11-Trimethyl-2,6,10-dodecatrien-1-ol

trans,trans-Farnesol

trans,trans-Farnesol, 97%+

trans-1,2-Cyclohexanediamine

trans-1,2-Diaminocyclohexane

trans-Cyclohexane-1,2-diamine

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.55 -0.46 -123.51 6 2 2 55 116.208 0
Hi High (pH 8-9.5) -0.55 -0.85 -36.13 5 2 1 54 115.2 0
Hi High (pH 8-9.5) 0.92 3.85 -96.7 7 9 2 135 421.505 5

Vendor Notes

Note Type Comments Provided By
Boiling_Point 104-110?/40mm Alfa-Aesar
BP 104-110° Oakwood Chemical
Boiling_Point 104-110°/40mm Alfa-Aesar
Mp [°C] 14 - 15 Acros Organics
Melting_Point 14-15? Alfa-Aesar
Melting_Point 14-15° Alfa-Aesar
BP [°C] 188 - 192 Acros Organics
Boiling_Point 191? Alfa-Aesar
Boiling_Point 191° Alfa-Aesar
Mp [°C] 2 - 15 Acros Organics
MP 33 - 35 Enamine Building Blocks
MP 33...35 Enamine Building Blocks
Mp [°C] 40 - 45 Acros Organics
Melting_Point 40-43? Alfa-Aesar
MP 40-43° Oakwood Chemical
BP [°C] 79 - 81 (p=15 torr) Acros Organics
BP 80 / 15 TCI
Boiling_Point 89-90?/14mm Alfa-Aesar
Boiling_Point 89-90°/14mm Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks
BP 92-93°/18mm Oakwood Chemical
purity 95 Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Purity 97% Fluorochem
therap antineoplastic MicroSource Spectrum
Hazard C: Corrosive Acros Organics
Target DNA/RNA Synthesis Selleck Chemicals
H phrase H314: Causes severe skin burns and eye damage Acros Organics
H phrase H314: Causes severe skin burns and eye damage; H317: May cause an allergic skin reaction Acros Organics
H phrase H314: Causes severe skin burns and eye damage; H335: May cause respiratory irritation; H302: Harmful if swallowed; H312: Harmful in contact with skin; H332: Harmful if inhaled Acros Organics
H phrase H318: Causes serious eye damage Acros Organics
H phrase H318: Causes serious eye damage; H314: Causes severe skin burns and eye damage Acros Organics
Warnings IRRITANT Matrix Scientific
P phrase P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting Acros Organics
P phrase P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting; P280: Wear eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue r Acros Organics
P phrase P301+ P330 + P331: IF SWALLOWED: Rinse mouth. Do NOT induce vomiting; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, Acros Organics
R phrase R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.; R35: Causes severe burns.; R37: Irritating to respiratory system.; R41: Risk of serious damage to eyes. Acros Organics
R phrase R34: Causes burns. Acros Organics
R phrase R34: Causes burns.; R41: Risk of serious damage to eyes.; R43: May cause sensitisation by skin contact. Acros Organics
S phrase S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Acros Organics
S phrase S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S45: In case of accident or if you feel unwell, seek medical advice immediat Acros Organics

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.