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192385-29-8 | L-Cysteine, N-acetyl-S-2-furanyl-
CAS No: 192385-29-8 Catalog No: AG002FWW MDL No:
Product Description
Catalog Number:
AG002FWW
Chemical Name:
L-Cysteine, N-acetyl-S-2-furanyl-
CAS Number:
192385-29-8
Molecular Formula:
C9H11NO4S
Molecular Weight:
229.2529
IUPAC Name:
(2R)-2-acetamido-3-(furan-2-ylsulfanyl)propanoic acid
InChI:
InChI=1S/C9H11NO4S/c1-6(11)10-7(9(12)13)5-15-8-3-2-4-14-8/h2-4,7H,5H2,1H3,(H,10,11)(H,12,13)/t7-/m0/s1
InChI Key:
PGYZSNNNIBUUAA-ZETCQYMHSA-N
SMILES:
CC(=O)N[C@H](C(=O)O)CSc1ccco1
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
229.041g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
229.25g/mol
Monoisotopic Mass:
229.041g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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