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130247-40-4 | L-Cysteine, S-(bromophenyl)- (9CI)
CAS No: 130247-40-4 Catalog No: AG000U6I MDL No:
Product Description
Catalog Number:
AG000U6I
Chemical Name:
L-Cysteine, S-(bromophenyl)- (9CI)
CAS Number:
130247-40-4
Molecular Formula:
C9H10BrNO2S
Molecular Weight:
276.1502
IUPAC Name:
(2R)-2-amino-3-(2-bromophenyl)sulfanylpropanoic acid
InChI:
InChI=1S/C9H10BrNO2S/c10-6-3-1-2-4-8(6)14-5-7(11)9(12)13/h1-4,7H,5,11H2,(H,12,13)/t7-/m0/s1
InChI Key:
OJNHWDRFPGCMJP-ZETCQYMHSA-N
SMILES:
OC(=O)[C@H](CSc1ccccc1Br)N
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
274.962g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
276.148g/mol
Monoisotopic Mass:
274.962g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
88.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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