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873009-45-1 | N-[(5-CHLORO-2-THIENYL)CARBONYL]GLYCINE
CAS No: 873009-45-1 Catalog No: AG004LIA MDL No:
Product Description
Catalog Number:
AG004LIA
Chemical Name:
N-[(5-CHLORO-2-THIENYL)CARBONYL]GLYCINE
CAS Number:
873009-45-1
Molecular Formula:
C7H6ClNO3S
Molecular Weight:
219.6454
IUPAC Name:
2-[(5-chlorothiophene-2-carbonyl)amino]acetic acid
InChI:
InChI=1S/C7H6ClNO3S/c8-5-2-1-4(13-5)7(12)9-3-6(10)11/h1-2H,3H2,(H,9,12)(H,10,11)
InChI Key:
HACZPPBLNKXGCR-UHFFFAOYSA-N
SMILES:
OC(=O)CNC(=O)c1ccc(s1)Cl
UNII:
21S18PUU5M
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.976g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
219.639g/mol
Monoisotopic Mass:
218.976g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
94.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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