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88963-31-9 | 1-Triazene, 3-hydroxy-1-(3-methoxyphenyl)-3-methyl-
CAS No: 88963-31-9 Catalog No: AG0045YW MDL No:
Product Description
Catalog Number:
AG0045YW
Chemical Name:
1-Triazene, 3-hydroxy-1-(3-methoxyphenyl)-3-methyl-
CAS Number:
88963-31-9
Molecular Formula:
C8H11N3O2
Molecular Weight:
181.1918
IUPAC Name:
[(3-methoxyphenyl)hydrazinylidene]-methyl-oxidoazanium
InChI:
InChI=1S/C8H11N3O2/c1-11(12)10-9-7-4-3-5-8(6-7)13-2/h3-6,9H,1-2H3
InChI Key:
ZXGNEFQKGAXXPM-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)N=NN(O)C
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.085g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.195g/mol
Monoisotopic Mass:
181.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.8
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