Home Carboxys N-Acetyl-3-(2-carboxypropyl)thio]alanine

N-Acetyl-3-(2-carboxypropyl)thio]alanine

CAS No.:
910898-81-6
Catalog Number:
AG00GXRH
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00GXRH
Chemical Name:
N-Acetyl-3-(2-carboxypropyl)thio]alanine
CAS Number:
910898-81-6
MDL Number:
MFCD23380221
IUPAC Name:
3-[(2S)-2-acetamido-2-carboxyethyl]sulfanyl-2-methylpropanoic acid
InChI:
InChI=1S/C9H15NO5S/c1-5(8(12)13)3-16-4-7(9(14)15)10-6(2)11/h5,7H,3-4H2,1-2H3,(H,10,11)(H,12,13)(H,14,15)/t5?,7-/m1/s1
InChI Key:
NCVHUCCOTCVUCB-NQPNHJOESA-N
Properties
Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
249.067g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
249.281g/mol
Monoisotopic Mass:
249.067g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
129A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties