Dicyclohexylcarbamoyl chloride

HCID 222909

Notes Reactions

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Basic information

CAS: 6292-88-2
Standard SMILES: O=C(Cl)N(C1CCCCC1)C1CCCCC1
InChIKey: KWWWNZDDRYZJGJ-UHFFFAOYSA-N
Molecular formula: C13H22ClNO
Average molar mass: 243.77 g/mol
Monoisotopic mass: 243.138992

Names & identifiers

Preferred name: Dicyclohexylcarbamoyl chloride
IUPAC: N,N-dicyclohexylcarbamoyl chloride

Names & synonyms

dicyclohexylcarbamoyl chloride6292-88-2NSC9971Dicyclohexylcarbamyl chlorideSCHEMBL372541Dicyclohexyl carbamoyl chlorideDTXSID80978738KWWWNZDDRYZJGJ-UHFFFAOYSA-NNSC-9971AKOS018445526

Database identifiers

CAS: 6292-88-2
PubChem CID: 222909
DTXSID: DTXSID80978738

Properties

Computed structural properties

XLogP: 4.4
Topological polar surface area: 20.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 2
Heavy atoms: 16
Formal charge: 0
Complexity: 214

Related reactions

16 records

New reaction record

HRID 209642As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

HRID 667664As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

HRID 835368As reactantTest data from https://doi.org/10.1039/C8SC04228D

HRID 1066702As productuspto-grants-2001_06

HRID 1128189As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

HRID 1212042As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

HRID 1370018As reactantuspto-grants-2003_06

HRID 1565691As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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