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200352-41-6 | D-Cysteine, S-[(acetylamino)methyl]-, monohydrochloride (9CI)
CAS No: 200352-41-6 Catalog No: AG002CP0 MDL No:MFCD00043380
Product Description
Catalog Number:
AG002CP0
Chemical Name:
D-Cysteine, S-[(acetylamino)methyl]-, monohydrochloride (9CI)
CAS Number:
200352-41-6
Molecular Formula:
C6H13ClN2O3S
Molecular Weight:
228.6970
MDL Number:
MFCD00043380
IUPAC Name:
(2S)-3-(acetamidomethylsulfanyl)-2-aminopropanoic acid;hydrochloride
InChI:
InChI=1S/C6H12N2O3S.ClH/c1-4(9)8-3-12-2-5(7)6(10)11;/h5H,2-3,7H2,1H3,(H,8,9)(H,10,11);1H/t5-;/m1./s1
InChI Key:
SZWPOAKLKGUXDD-NUBCRITNSA-N
SMILES:
CC(=O)NCSC[C@H](C(=O)O)N.Cl
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
228.034g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
228.691g/mol
Monoisotopic Mass:
228.034g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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