200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1263078-10-9
1263078-10-9 | 1,3-Pyrrolidinedicarboxylic acid, 3-ethyl 1-(phenylmethyl) ester, (3R)-
CAS No: 1263078-10-9 Catalog No: AG000SIV MDL No:MFCD11053571
Product Description
Catalog Number:
AG000SIV
Chemical Name:
1,3-Pyrrolidinedicarboxylic acid, 3-ethyl 1-(phenylmethyl) ester, (3R)-
CAS Number:
1263078-10-9
Molecular Formula:
C15H19NO4
Molecular Weight:
277.3157
MDL Number:
MFCD11053571
IUPAC Name:
1-O-benzyl 3-O-ethyl (3R)-pyrrolidine-1,3-dicarboxylate
InChI:
InChI=1S/C15H19NO4/c1-2-19-14(17)13-8-9-16(10-13)15(18)20-11-12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3/t13-/m1/s1
InChI Key:
PXTGBVCFUXOCMF-CYBMUJFWSA-N
SMILES:
CCOC(=O)[C@@H]1CCN(C1)C(=O)OCc1ccccc1
Properties
Complexity:
339
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
277.131g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.32g/mol
Monoisotopic Mass:
277.131g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.