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89544-51-4 | Oxirane, 2-(3-butenyl)-2-(2,4-dichlorophenyl)-
CAS No: 89544-51-4 Catalog No: AG003YLA MDL No:
Product Description
Catalog Number:
AG003YLA
Chemical Name:
Oxirane, 2-(3-butenyl)-2-(2,4-dichlorophenyl)-
CAS Number:
89544-51-4
Molecular Formula:
C12H12Cl2O
Molecular Weight:
243.1291
IUPAC Name:
2-but-3-enyl-2-(2,4-dichlorophenyl)oxirane
InChI:
InChI=1S/C12H12Cl2O/c1-2-3-6-12(8-15-12)10-5-4-9(13)7-11(10)14/h2,4-5,7H,1,3,6,8H2
InChI Key:
IGBYTQSBHCGDOE-UHFFFAOYSA-N
SMILES:
C=CCCC1(CO1)c1ccc(cc1Cl)Cl
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.027g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.127g/mol
Monoisotopic Mass:
242.027g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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