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95-71-6 | 2-Methylbenzene-1,4-diol
CAS No: 95-71-6 Catalog No: AG003HPI MDL No:MFCD00002345
Product Description
Catalog Number:
AG003HPI
Chemical Name:
2-Methylbenzene-1,4-diol
CAS Number:
95-71-6
Molecular Formula:
C7H8O2
Molecular Weight:
124.1372
MDL Number:
MFCD00002345
IUPAC Name:
2-methylbenzene-1,4-diol
InChI:
InChI=1S/C7H8O2/c1-5-4-6(8)2-3-7(5)9/h2-4,8-9H,1H3
InChI Key:
CNHDIAIOKMXOLK-UHFFFAOYSA-N
SMILES:
Oc1ccc(c(c1)C)O
EC Number:
202-443-7
UNII:
332W51E0OC
NSC Number:
4962
Properties
Complexity:
92.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.052g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
124.139g/mol
Monoisotopic Mass:
124.052g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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