CAS 2623-91-8 | Butanoic acid, 2-amino-, (2R)- | CAS Number 2623-91-8

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2623-91-8 | Butanoic acid, 2-amino-, (2R)-

CAS No: 2623-91-8 Catalog No: AG002SEC MDL No:MFCD00064414

Product Description

Catalog Number:

AG002SEC

Chemical Name:

Butanoic acid, 2-amino-, (2R)-

CAS Number:

2623-91-8

Molecular Formula:

C4H9NO2

Molecular Weight:

103.1198

MDL Number:

MFCD00064414

IUPAC Name:

(2R)-2-aminobutanoic acid

InChI:

InChI=1S/C4H9NO2/c1-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m1/s1

InChI Key:

QWCKQJZIFLGMSD-GSVOUGTGSA-N

SMILES:

CC[C@H](C(=O)O)N

EC Number:

220-084-4

Properties

Complexity:

72.1

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

103.063g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

103.121g/mol

Monoisotopic Mass:

103.063g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-2.5

Literature

Title	Journal
Drug design, in vitro pharmacology, and structure-activity relationships of 3-acylamino-2-aminopropionic acid derivatives, a novel class of partial agonists at the glycine site on the N-methyl-D-aspartate (NMDA) receptor complex.	Journal of medicinal chemistry 20090827