4,4'-Methylenebis(cyclohexyl N-phenylcarbamate)
Basic information
- CAS
76788-43-7- Standard SMILES
O=C(Nc1ccc(Cc2ccc(NC(=O)OC3CCCCC3)cc2)cc1)OC1CCCCC1- InChIKey
LIMGWHSDVWULRD-UHFFFAOYSA-N- Molecular formula
- C27H34N2O4
- Average molar mass
- 450.6 g/mol
- Monoisotopic mass
- 450.25185757
Names & identifiers
- Preferred name
- 4,4'-Methylenebis(cyclohexyl N-phenylcarbamate)
- IUPAC
- cyclohexyl N-[4-[[4-(cyclohexyloxycarbonylamino)phenyl]methyl]phenyl]carbamate
Names & synonyms
4,4'-METHYLENEBIS(CYCLOHEXYL N-PHENYLCARBAMATE)RefChem:50681176788-43-7667-393-4SCHEMBL5026905AKOS024382288ST51030580cyclohexyloxy-N-(4-{[4-(cyclohexyloxycarbonylamino)phenyl]methyl}phenyl)carbox amide
Database identifiers
- CAS
76788-43-7- PubChem CID
- 3510071
- EC Number
- 667-393-4
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 547
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Chronic 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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