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119055-67-3 | 1,3-Benzodioxole, 5-(1-methylethenyl)-
CAS No: 119055-67-3 Catalog No: AG000I4R MDL No:
Product Description
Catalog Number:
AG000I4R
Chemical Name:
1,3-Benzodioxole, 5-(1-methylethenyl)-
CAS Number:
119055-67-3
Molecular Formula:
C10H10O2
Molecular Weight:
162.1852
IUPAC Name:
5-prop-1-en-2-yl-1,3-benzodioxole
InChI:
InChI=1S/C10H10O2/c1-7(2)8-3-4-9-10(5-8)12-6-11-9/h3-5H,1,6H2,2H3
InChI Key:
HVXSFCYOHKGEPJ-UHFFFAOYSA-N
SMILES:
CC(=C)c1ccc2c(c1)OCO2
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.068g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.188g/mol
Monoisotopic Mass:
162.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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