UCSF

ZINC04658592

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 22nd, 2005 5 Yes

Popular Name: (S)-(+)-1-Amino-2-propanol (S)-(+)-1-Amino-2-propanol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 2799-16-8 , 2799-17-9 , 6168-72-5 , 67952-32-3 , 78-96-6 , [2799-17-9]

Other Names:

"DL-1-Amino-2-propanol, 99.5%"

(+)-ISOPROPANOLAMINE

(+/-)-1-Amino-2-propanol

(+/-)-1-Amino-2-propanol, 94%, remainder 2-amino-1-propanol

(+/-)-1-Amino-2-propanol; (+/-)-Isopropanolamine; (R)-1-aminopropan-2-ol; (RS)-1-Amino-2-hydroxypropane; (RS)-1-amino-2-propanol; .alpha.-Aminoisopropyl alcohol; 1-AMINO-2-PROPANOL; 1-Amino-2-hydroxypropane; 1-Aminopropan-2-ol; 1-Methyl-2-aminoethanol; 1-

(+/-)-Isopropanolamine

(2S)-(+)-1-Aminopropan-2-ol

(2S)-1-aminopropan-2-ol

(R)-(-)-1-Amino-2-propanol

(R)-(-)-1-aminopropan-2-ol

(R)-1-aminopropan-2-ol; 1-amino-2-propanol; 1-amino-propan-2-ol; 3-amino-2-propanol; 78-96-6; D-1-amino-2-propanol; D-1-aminopropan-2-ol; DL-1-amino-2-propanol; aminopropanol

(S)-(+)-1-Amino-2-propanol, 98%

(S)-(+)-1-Amino-2-propanol, 98+%

(S)-(+)-Isopropanolamine

(S)-1-Amino-2-propanol

(S)-1-Aminopropan-2-ol

(^+)-Isopropanolamine

(±)-Isopropanolamine

1-amino-2-Hydroxypropanamine; 1-Aminopropan-2-ol; 2-Hydroxypropylamine; 2-Propanol; aminopropanol; Mipa; Mono-iso-propanolamine; Monoisopropanolamine; Threamine

1-Amino-2-Hydroxypropanamine;1-Aminopropan-2-ol;2-Hydroxypropylamine;Aminopropanol;Mipa;Mono-iso-propanolamine;Monoisopropanolamine;Threamine

1-Amino-2-hydroxypropane; 1-Amino-2-propanol; 1-Aminopropan-2-ol; 1-Methyl-2-aminoethanol; 2-Amino-1-methylethanol; 2-Hydroxy-1-propylamine; 2-Hydroxypropanamine; 2-Hydroxypropylamine; 2-Propanol, 1-amino-; AI3-14653; BRN 0605275; CCRIS 2284; EINECS 201-1

1-AMINO-2-PROPANOL

1-Amino-2-propanol; 1-Aminopropan-2-ol; 78-96-6; C05771

1-Amino-propan-2-ol

1-aminopropan-2-ol

Amino-2-propanol

AMINOPROPANO

DL-1-Amino-2-propanol

DL-1-Amino-2-propanol, 94%, contains approx. 5% 2-Amino-1-propanol

F-Loop of Vitamin B12

Isopropanolamine Phosphate

MFCD00008139

MFCD00064429

MFCD00070562

OR-3440

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) -1.15 -4.56 -37.74 4 2 1 47 76.119 1 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 2 Acros Organics
BP [°C] 160 Acros Organics
Boiling_Point 160? Alfa-Aesar
Boiling_Point 160° Alfa-Aesar
BP [°C] 161 Acros Organics
Mp [°C] 19 - 21 Acros Organics
Melting_Point 24-26? Alfa-Aesar
Melting_Point 24-26° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks
ALOGPS_SOLUBILITY 9.99e+01 g/l DrugBank-experimental
purity 95 Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Purity 98% Fluorochem
Hazard C: Corrosive Acros Organics
H phrase H314: Causes severe skin burns and eye damage 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 R34: Causes burns. Acros Organics
S phrase S23: Do not breathe gas/fumes/vapour/spray. Acros Organics
S phrase S23: Do not breathe gas/fumes/vapour/spray.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36: Wear suitable protective clothing.; S45: In case of accident or if you feel unwell, seek medical advice i Acros Organics

Activity (Go SEA)

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

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