200,000+ products from a single source!

sales@angenechem.com

Home > Carboxes > 1374658-54-4

1374658-54-4

1374658-54-4 | 1-Azetidinecarboxylic acid, 3-fluoro-3-(hydroxymethyl)-, phenylmethyl ester

CAS No: 1374658-54-4 Catalog No: AG0013BI MDL No:MFCD24857029

Product Description

Catalog Number:
AG0013BI
Chemical Name:
1-Azetidinecarboxylic acid, 3-fluoro-3-(hydroxymethyl)-, phenylmethyl ester
CAS Number:
1374658-54-4
Molecular Formula:
C12H14FNO3
Molecular Weight:
239.2429
MDL Number:
MFCD24857029
IUPAC Name:
benzyl 3-fluoro-3-(hydroxymethyl)azetidine-1-carboxylate
InChI:
InChI=1S/C12H14FNO3/c13-12(9-15)7-14(8-12)11(16)17-6-10-4-2-1-3-5-10/h1-5,15H,6-9H2
InChI Key:
PRDGFXHPHNMFIJ-UHFFFAOYSA-N
SMILES:
OCC1(F)CN(C1)C(=O)OCc1ccccc1

Properties

Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.096g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
239.246g/mol
Monoisotopic Mass:
239.096g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

© 2019 Angene International Limited. All rights Reserved.