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87005-10-5 | 3-methyl-1,2-dihydronaphthalene-1,2-diol
CAS No: 87005-10-5 Catalog No: AG004NRG MDL No:
Product Description
Catalog Number:
AG004NRG
Chemical Name:
3-methyl-1,2-dihydronaphthalene-1,2-diol
CAS Number:
87005-10-5
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
IUPAC Name:
3-methyl-1,2-dihydronaphthalene-1,2-diol
InChI:
InChI=1S/C11H12O2/c1-7-6-8-4-2-3-5-9(8)11(13)10(7)12/h2-6,10-13H,1H3
InChI Key:
FDYLZIRXNOBIGV-UHFFFAOYSA-N
SMILES:
CC1=Cc2ccccc2C(C1O)O
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
176.215g/mol
Monoisotopic Mass:
176.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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