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139300-92-8 | Phosphonic dichloride, (2,4-dichlorobutyl)- (9CI)
CAS No: 139300-92-8 Catalog No: AG001APE MDL No:
Product Description
Catalog Number:
AG001APE
Chemical Name:
Phosphonic dichloride, (2,4-dichlorobutyl)- (9CI)
CAS Number:
139300-92-8
Molecular Formula:
C4H7Cl4OP
Molecular Weight:
243.8835
IUPAC Name:
2,4-dichloro-1-dichlorophosphorylbutane
InChI:
InChI=1S/C4H7Cl4OP/c5-2-1-4(6)3-10(7,8)9/h4H,1-3H2
InChI Key:
QGGPXVQXVAVSLK-UHFFFAOYSA-N
SMILES:
ClCCC(CP(=O)(Cl)Cl)Cl
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.896g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.873g/mol
Monoisotopic Mass:
241.899g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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