Carbamic acid, (4-butoxy-2-methylphenyl)-, 2-(dibutylamino)ethyl ester

HCID 3048784

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Basic information

CAS: 63986-49-2
Standard SMILES: CCCCOc1ccc(NC(=O)OCCN(CCCC)CCCC)c(C)c1
InChIKey: DQVREVNUKLHQNN-UHFFFAOYSA-N
Molecular formula: C22H38N2O3
Average molar mass: 378.5 g/mol
Monoisotopic mass: 378.28824308

Names & identifiers

Preferred name: Carbamic acid, (4-butoxy-2-methylphenyl)-, 2-(dibutylamino)ethyl ester
IUPAC: 2-(dibutylamino)ethyl N-(4-butoxy-2-methylphenyl)carbamate

Names & synonyms

KL 3614Carbamic acid, (4-butoxy-2-methylphenyl)-, 2-(dibutylamino)ethyl ester2-(Dibutylamino)ethyl (4-butoxy-2-methylphenyl)carbamate63986-49-2DTXSID40213915RefChem:332114DTXCID70136406

Database identifiers

CAS: 63986-49-2
PubChem CID: 3048784
DTXSID: DTXSID40213915

Properties

Computed structural properties

XLogP: 5.6
Topological polar surface area: 50.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 15
Heavy atoms: 27
Formal charge: 0
Complexity: 371

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