UCSF

ZINC01752310

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 9 No

Popular Name: Cyclohexanecarbonyl chloride Cyclohexanecarbonyl chloride

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CAS Numbers: 2719-27-9 , 98-88-4 , N/A , [2719-27-9]

Download: MOL2 SDF SMILES Flexibase

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) 3.08 5.12 -2.68 0 1 0 17 146.617 1 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 1? Alfa-Aesar
Melting_Point 1° Alfa-Aesar
MP 168 - 170 Enamine Building Blocks
MP 168...170 Enamine Building Blocks
Boiling_Point 183-185? Alfa-Aesar
Boiling_Point 183-185° Alfa-Aesar
BP [°C] 184 Acros Organics
BP 185 TCI
Boiling_Point 197-199? Alfa-Aesar
Boiling_Point 197-199° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Hazard C: Corrosive Acros Organics
H phrase H318: Causes serious eye damage Acros Organics
H phrase H318: Causes serious eye damage; H302: Harmful if swallowed; H314: Causes severe skin burns and eye damage Acros Organics
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 R22: Harmful if swallowed. Acros Organics
R phrase R22: Harmful if swallowed.; R34: Causes burns. 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

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