Benzoic acid, 3-((dipropylamino)carbonyl)-, methyl ester

HCID 182776

Completing data — usually done within a minute

Basic information

CAS
126926-42-9
Standard SMILES
CCCN(CCC)C(=O)c1cccc(C(=O)OC)c1
InChIKey
ANRXZTNRUXAXQP-UHFFFAOYSA-N
Molecular formula
C15H21NO3
Average molar mass
263.33 g/mol
Monoisotopic mass
263.15214353

Names & identifiers

Preferred name
Benzoic acid, 3-((dipropylamino)carbonyl)-, methyl ester
IUPAC
methyl 3-(dipropylcarbamoyl)benzoate

Names & synonyms

126926-42-9methyl 3-(dipropylcarbamoyl)benzoateBenzoic acid, 3-((dipropylamino)carbonyl)-, methyl esterBenzoic acid, 3-[(dipropylamino)carbonyl]-, methyl esterMethyl 3-((dipropylamino)carbonyl)benzoateSCHEMBL2204729DTXSID80155345ANRXZTNRUXAXQP-UHFFFAOYSA-NDB-208299

Database identifiers

CAS
126926-42-9
PubChem CID
182776
DTXSID
DTXSID80155345

Properties

Computed structural propertiesFilling in

XLogP
3.6
Topological polar surface area
46.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
19

Related reactions

3 records

Compound notes

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