UCSF

ZINC00035771

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 11 No

Popular Name: 4-(Bromomethyl)benzoic acid 4-(Bromomethyl)benzoic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 6232-88-8 , [6232-88-8]

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) 2.56 0.21 -50.06 0 2 -1 40 214.038 2 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 223 - 227 Acros Organics
Melting_Point 223-227? Alfa-Aesar
Melting_Point 223-227° Alfa-Aesar
MP 228 - 232 Enamine Building Blocks
MP 228...232 Enamine Building Blocks
MP 230 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Matrix Scientific
Hazard C: Corrosive Acros Organics
Warnings Corrosive/Lachrymator Matrix Scientific
H phrase H314: Causes severe skin burns and eye damage Acros Organics
H phrase H314: Causes severe skin burns and eye damage; H318: Causes serious eye damage Acros Organics
Warnings LACHRYMATOR, CORROSIVE 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
R phrase R34: Causes burns. Acros Organics
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics
S phrase S24/25: Avoid contact with skin and eyes.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Acros Organics

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