200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 188660-14-2
188660-14-2 | D-Threonine, O-(phenylmethyl)-, phenylmethyl ester, ethanedioate (1:1)
CAS No: 188660-14-2 Catalog No: AG002H3R MDL No:MFCD02259517
Product Description
Catalog Number:
AG002H3R
Chemical Name:
D-Threonine, O-(phenylmethyl)-, phenylmethyl ester, ethanedioate (1:1)
CAS Number:
188660-14-2
Molecular Formula:
C20H23NO7
Molecular Weight:
389.3991
MDL Number:
MFCD02259517
IUPAC Name:
benzyl (2R,3S)-2-amino-3-phenylmethoxybutanoate;oxalic acid
InChI:
InChI=1S/C18H21NO3.C2H2O4/c1-14(21-12-15-8-4-2-5-9-15)17(19)18(20)22-13-16-10-6-3-7-11-16;3-1(4)2(5)6/h2-11,14,17H,12-13,19H2,1H3;(H,3,4)(H,5,6)/t14-,17+;/m0./s1
InChI Key:
IIAVXHHGVJCFKI-SQQLFYIASA-N
SMILES:
N[C@@H](C(=O)OCc1ccccc1)[C@@H](OCc1ccccc1)C.OC(=O)C(=O)O
Properties
Complexity:
394
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
389.147g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
389.404g/mol
Monoisotopic Mass:
389.147g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
136A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.