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88438-21-5 | Cyclopropanemethanol, 2,2-dichloro-3,3-dimethyl-, methanesulfonate
CAS No: 88438-21-5 Catalog No: AG004HI0 MDL No:
Product Description
Catalog Number:
AG004HI0
Chemical Name:
Cyclopropanemethanol, 2,2-dichloro-3,3-dimethyl-, methanesulfonate
CAS Number:
88438-21-5
Molecular Formula:
C7H14Cl2O4S
Molecular Weight:
265.1547
IUPAC Name:
(2,2-dichloro-3,3-dimethylcyclopropyl)methanol;methanesulfonic acid
InChI:
InChI=1S/C6H10Cl2O.CH4O3S/c1-5(2)4(3-9)6(5,7)8;1-5(2,3)4/h4,9H,3H2,1-2H3;1H3,(H,2,3,4)
InChI Key:
CRWVPLXLGNFCTF-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)O.OCC1C(C1(C)C)(Cl)Cl
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.999g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
265.145g/mol
Monoisotopic Mass:
263.999g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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