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123090-06-2 | Glycine, N-[(6-chloro-2-naphthalenyl)sulfonyl]-
CAS No: 123090-06-2 Catalog No: AG000K12 MDL No:
Product Description
Catalog Number:
AG000K12
Chemical Name:
Glycine, N-[(6-chloro-2-naphthalenyl)sulfonyl]-
CAS Number:
123090-06-2
Molecular Formula:
C12H10ClNO4S
Molecular Weight:
299.7301
IUPAC Name:
2-[(6-chloronaphthalen-2-yl)sulfonylamino]acetic acid
InChI:
InChI=1S/C12H10ClNO4S/c13-10-3-1-9-6-11(4-2-8(9)5-10)19(17,18)14-7-12(15)16/h1-6,14H,7H2,(H,15,16)
InChI Key:
DSOQMSYNBSAEGG-UHFFFAOYSA-N
SMILES:
OC(=O)CNS(=O)(=O)c1ccc2c(c1)ccc(c2)Cl
Properties
Complexity:
434
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.002g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
299.725g/mol
Monoisotopic Mass:
299.002g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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