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952-47-6 | 2-Phenylazo-4-methylphenol , 98%
CAS No: 952-47-6 Catalog No: AG003HV5 MDL No:MFCD00045788
Product Description
Catalog Number:
AG003HV5
Chemical Name:
2-Phenylazo-4-methylphenol , 98%
CAS Number:
952-47-6
Molecular Formula:
C13H12N2O
Molecular Weight:
212.2472
MDL Number:
MFCD00045788
IUPAC Name:
4-methyl-2-phenyldiazenylphenol
InChI:
InChI=1S/C13H12N2O/c1-10-7-8-13(16)12(9-10)15-14-11-5-3-2-4-6-11/h2-9,16H,1H3
InChI Key:
NJOXSODFMZIZJD-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)/N=N/c1ccccc1)O
NSC Number:
85564
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.252g/mol
Monoisotopic Mass:
212.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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