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88011-20-5 | Phosphonic dichloride, (1-carbonyl-2-methylpropyl)-
CAS No: 88011-20-5 Catalog No: AG004NVZ MDL No:
Product Description
Catalog Number:
AG004NVZ
Chemical Name:
Phosphonic dichloride, (1-carbonyl-2-methylpropyl)-
CAS Number:
88011-20-5
Molecular Formula:
C5H7Cl2O2P
Molecular Weight:
200.9876
IUPAC Name:
2-dichlorophosphoryl-3-methylbut-1-en-1-one
InChI:
InChI=1S/C5H7Cl2O2P/c1-4(2)5(3-8)10(6,7)9/h4H,1-2H3
InChI Key:
HOTMYMXVQOFZCL-UHFFFAOYSA-N
SMILES:
O=C=C(P(=O)(Cl)Cl)C(C)C
Properties
Complexity:
212
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.956g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.983g/mol
Monoisotopic Mass:
199.956g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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