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84819-80-7 | Phenol, 4-chloro-2-[(5-methyl-3-isoxazolyl)azo]-
CAS No: 84819-80-7 Catalog No: AG004QU5 MDL No:
Product Description
Catalog Number:
AG004QU5
Chemical Name:
Phenol, 4-chloro-2-[(5-methyl-3-isoxazolyl)azo]-
CAS Number:
84819-80-7
Molecular Formula:
C10H8ClN3O2
Molecular Weight:
237.6424
IUPAC Name:
4-chloro-2-[(5-methyl-1,2-oxazol-3-yl)diazenyl]phenol
InChI:
InChI=1S/C10H8ClN3O2/c1-6-4-10(14-16-6)13-12-8-5-7(11)2-3-9(8)15/h2-5,15H,1H3
InChI Key:
GBWRQZBSUHLWKA-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)N=Nc1noc(c1)C)O
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.031g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.643g/mol
Monoisotopic Mass:
237.031g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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