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882036-83-1 | 1,3-Benzodioxole-5-carbonyl chloride, 7-methoxy-2,2-dimethyl-
CAS No: 882036-83-1 Catalog No: AG004C3P MDL No:
Product Description
Catalog Number:
AG004C3P
Chemical Name:
1,3-Benzodioxole-5-carbonyl chloride, 7-methoxy-2,2-dimethyl-
CAS Number:
882036-83-1
Molecular Formula:
C11H11ClO4
Molecular Weight:
242.6556
IUPAC Name:
7-methoxy-2,2-dimethyl-1,3-benzodioxole-5-carbonyl chloride
InChI:
InChI=1S/C11H11ClO4/c1-11(2)15-8-5-6(10(12)13)4-7(14-3)9(8)16-11/h4-5H,1-3H3
InChI Key:
YEKRKLXZRJJLNC-UHFFFAOYSA-N
SMILES:
COc1cc(cc2c1OC(O2)(C)C)C(=O)Cl
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.035g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.655g/mol
Monoisotopic Mass:
242.035g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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