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88367-27-5

88367-27-5 | 1,2-Benzenediol, 3-methoxy-6-methyl-

CAS No: 88367-27-5 Catalog No: AG004MP4 MDL No:

Product Description

Catalog Number:
AG004MP4
Chemical Name:
1,2-Benzenediol, 3-methoxy-6-methyl-
CAS Number:
88367-27-5
Molecular Formula:
C8H10O3
Molecular Weight:
154.1632
IUPAC Name:
3-methoxy-6-methylbenzene-1,2-diol
InChI:
InChI=1S/C8H10O3/c1-5-3-4-6(11-2)8(10)7(5)9/h3-4,9-10H,1-2H3
InChI Key:
TWXQXLIAMSCBKL-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1O)O)C

Properties

Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.063g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
154.165g/mol
Monoisotopic Mass:
154.063g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

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