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88631-90-7

88631-90-7 | 1,3-Benzodioxol-5-ol, 4,7-dimethyl-

CAS No: 88631-90-7 Catalog No: AG0049UL MDL No:MFCD24725041

Product Description

Catalog Number:
AG0049UL
Chemical Name:
1,3-Benzodioxol-5-ol, 4,7-dimethyl-
CAS Number:
88631-90-7
Molecular Formula:
C9H10O3
Molecular Weight:
166.1739
MDL Number:
MFCD24725041
IUPAC Name:
4,7-dimethyl-1,3-benzodioxol-5-ol
InChI:
InChI=1S/C9H10O3/c1-5-3-7(10)6(2)9-8(5)11-4-12-9/h3,10H,4H2,1-2H3
InChI Key:
XLYKQGVKAPFTNM-UHFFFAOYSA-N
SMILES:
Oc1cc(C)c2c(c1C)OCO2

Properties

Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.063g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
166.176g/mol
Monoisotopic Mass:
166.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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