(1-Methylpyrrolidin-2-yl)methyl hydroxy(diphenyl)acetate

HCID 59239

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Basic information

CAS: 102156-75-2
Standard SMILES: CN1CCCC1COC(=O)C(O)(c1ccccc1)c1ccccc1
InChIKey: PVTRRFZPTJJKAI-UHFFFAOYSA-N
Molecular formula: C20H23NO3
Average molar mass: 325.4 g/mol
Monoisotopic mass: 325.1677936

Names & identifiers

Preferred name: (1-Methylpyrrolidin-2-yl)methyl hydroxy(diphenyl)acetate
IUPAC: (1-methylpyrrolidin-2-yl)methyl 2-hydroxy-2,2-diphenylacetate

Names & synonyms

102156-75-2DTXSID20907183(1-methylpyrrolidin-2-yl)methyl hydroxy(diphenyl)acetateRefChem:1049302DTXCID301336273BRL 485(1-Methylpyrrolid-2-yl)methyl benzilateBRN 02935962-Pyrrolidinemethanol, 1-methyl-, benzilateBENZILIC ACID, (1-METHYL-2-PYRROLIDINYL)METHYL ESTER4-21-00-00059 (Beilstein Handbook Reference)(1-Methylpyrrolidin-2-yl)methyl hydroxydi(phenyl)acetate

Database identifiers

CAS: 102156-75-2
PubChem CID: 59239
DTXSID: DTXSID20907183

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 49.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 6
Heavy atoms: 24
Formal charge: 0
Complexity: 395

Related reactions

1 records

New reaction record

HRID 804199As productTest data from https://doi.org/10.1039/C8SC04228D

Compound notes

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