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616-91-1 | N-Acetyl-L-cysteine
CAS No: 616-91-1 Catalog No: AG0035C0 MDL No:MFCD00004880
Product Description
Catalog Number:
AG0035C0
Chemical Name:
N-Acetyl-L-cysteine
CAS Number:
616-91-1
Molecular Formula:
C5H9NO3S
Molecular Weight:
163.1949
MDL Number:
MFCD00004880
IUPAC Name:
(2R)-2-acetamido-3-sulfanylpropanoic acid
InChI:
InChI=1S/C5H9NO3S/c1-3(7)6-4(2-10)5(8)9/h4,10H,2H2,1H3,(H,6,7)(H,8,9)/t4-/m0/s1
InChI Key:
PWKSKIMOESPYIA-BYPYZUCNSA-N
SMILES:
SC[C@@H](C(=O)O)NC(=O)C
EC Number:
210-498-3
UNII:
WYQ7N0BPYC
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
163.03g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
163.191g/mol
Monoisotopic Mass:
163.03g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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