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143809-23-8 | 1,4-Benzodioxin-6-carbonyl chloride, 2,3-dihydro-5-methyl-
CAS No: 143809-23-8 Catalog No: AG001IEY MDL No:
Product Description
Catalog Number:
AG001IEY
Chemical Name:
1,4-Benzodioxin-6-carbonyl chloride, 2,3-dihydro-5-methyl-
CAS Number:
143809-23-8
Molecular Formula:
C10H9ClO3
Molecular Weight:
212.6297
IUPAC Name:
5-methyl-2,3-dihydro-1,4-benzodioxine-6-carbonyl chloride
InChI:
InChI=1S/C10H9ClO3/c1-6-7(10(11)12)2-3-8-9(6)14-5-4-13-8/h2-3H,4-5H2,1H3
InChI Key:
MBNXDUVKJWVZOY-UHFFFAOYSA-N
SMILES:
ClC(=O)c1ccc2c(c1C)OCCO2
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.024g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.629g/mol
Monoisotopic Mass:
212.024g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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