UCSF

ZINC12359965

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2008 15 Yes

Popular Name: 4,4'-Methylenedicyclohexanamine 4,4'-Methylenedicyclohexanamine

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CAS Numbers: 1761-71-3 , [1761-71-3]

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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) 1.30 3.51 -90.7 6 2 2 55 212.381 2 ↓

Vendor Notes

Note Type Comments Provided By
BP 126 / 0.3 TCI
Boiling_Point 325-327? Alfa-Aesar
Boiling_Point 325-327° Alfa-Aesar
Purity 95% Fluorochem
Hazard C: Corrosive; N: Dangerous for the environment Acros Organics
Melting_Point ca 43? Alfa-Aesar
Melting_Point ca 43° Alfa-Aesar
H phrase H302: Harmful if swallowed; H314: Causes severe skin burns and eye damage; H317: May cause an allergic skin reaction; H373: May cause damage to organs through prolonged or repeated exposure; H411: Toxic to aquatic life with long lasting effects Acros Organics
P phrase 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, if present and easy to do. Continue rinsing; P273: Avoid release to th Acros Organics
R phrase R22: Harmful if swallowed.; R35: Causes severe burns.; R43: May cause sensitisation by skin contact.; R48/22: Harmful : danger of serious damage to health by prolonged exposure if swallowed.; R51/53: Toxic to aquatic organisms, may cause long-term adverse Acros Organics
PUBCHEM_PATENT_ID WO1998057956A1 IBM Patent Data

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