200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 1251904-00-3
1251904-00-3 | D-Aspartic acid, N,N-bis[(1,1-dimethylethoxy)carbonyl]-, 1,4-dimethyl ester
CAS No: 1251904-00-3 Catalog No: AG000NC4 MDL No:
Product Description
Catalog Number:
AG000NC4
Chemical Name:
D-Aspartic acid, N,N-bis[(1,1-dimethylethoxy)carbonyl]-, 1,4-dimethyl ester
CAS Number:
1251904-00-3
Molecular Formula:
C16H27NO8
Molecular Weight:
361.3875
IUPAC Name:
(E)-3-(1,3-benzodioxol-5-yl)-2-(3-fluorophenyl)prop-2-enenitrile
InChI:
InChI=1S/C16H10FNO2/c17-14-3-1-2-12(8-14)13(9-18)6-11-4-5-15-16(7-11)20-10-19-15/h1-8H,10H2/b13-6-
InChI Key:
SBILMTRMWVYZQJ-MLPAPPSSSA-N
SMILES:
COC(=O)C[C@@H](N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)OC
Properties
Complexity:
427
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
267.07g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.259g/mol
Monoisotopic Mass:
267.07g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.