UCSF

ZINC12360036

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2008 16 Yes

Popular Name: (R)-(+)-N-Benzyl-1-phenylethylamine (R)-(+)-N-Benzyl-1-phenylethylamine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 128593-66-8 , 17480-69-2 , 3193-62-2 , 38235-77-7 , 49746-32-9 , [38235-77-7]

Download: MOL2 SDF SMILES Flexibase

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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) 3.45 9.01 -40.34 2 1 1 17 212.316 4 ↓
Hi High (pH 8-9.5) 3.45 7.75 -3.1 1 1 0 12 211.308 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 106 - 109 Enamine Building Blocks
MP 106...109 Enamine Building Blocks
Boiling_Point 171?/15mm Alfa-Aesar
Boiling_Point 171°/15mm Alfa-Aesar
Mp [°C] 181 - 183 Acros Organics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95+% Matrix Scientific
Purity 98% Fluorochem
H phrase H332: Harmful if inhaled Acros Organics
H phrase H332: Harmful if inhaled; H302: Harmful if swallowed; H315: Causes skin irritation; H312: Harmful in contact with skin; H335: May cause respiratory irritation; H319: Causes serious eye irritation Acros Organics
Warnings IRRITANT Matrix Scientific
Warnings Irritant/Air Sensitive Matrix Scientific
P phrase P280: Wear protective gloves/protective clothing/eye protection/face protection Acros Organics
P phrase P280: Wear protective gloves/protective clothing/eye protection/face protection; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/p Acros Organics
R phrase R20/21/22: Harmful by inhalation, in contact with skin and if swallowed. Acros Organics
R phrase R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin. 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. Acros Organics
Hazard XN: Harmful Acros Organics

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