200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1235011-96-7
1235011-96-7 | 3-Morpholinecarboxylic acid, 4-(phenylmethyl)-, (3S)-
CAS No: 1235011-96-7 Catalog No: AG000KP7 MDL No:MFCD06799463
Product Description
Catalog Number:
AG000KP7
Chemical Name:
3-Morpholinecarboxylic acid, 4-(phenylmethyl)-, (3S)-
CAS Number:
1235011-96-7
Molecular Formula:
C12H15NO3
Molecular Weight:
221.2524
MDL Number:
MFCD06799463
IUPAC Name:
(3S)-4-benzylmorpholine-3-carboxylic acid
InChI:
InChI=1S/C12H15NO3/c14-12(15)11-9-16-7-6-13(11)8-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,14,15)/t11-/m0/s1
InChI Key:
XZVHBJHXLYHSNN-NSHDSACASA-N
SMILES:
OC(=O)[C@@H]1COCCN1Cc1ccccc1
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
221.105g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.256g/mol
Monoisotopic Mass:
221.105g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.