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821009-63-6 | Phosphinic acid, (3-chlorophenyl)-, butyl ester
CAS No: 821009-63-6 Catalog No: AG0051J5 MDL No:
Product Description
Catalog Number:
AG0051J5
Chemical Name:
Phosphinic acid, (3-chlorophenyl)-, butyl ester
CAS Number:
821009-63-6
Molecular Formula:
C10H14ClO2P
Molecular Weight:
232.6437
IUPAC Name:
butoxy-(3-chlorophenyl)-oxophosphanium
InChI:
InChI=1S/C10H13ClO2P/c1-2-3-7-13-14(12)10-6-4-5-9(11)8-10/h4-6,8H,2-3,7H2,1H3/q+1
InChI Key:
VOUSGZXKXYDIBS-UHFFFAOYSA-N
SMILES:
CCCCOP(=O)c1cccc(c1)Cl
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.034g/mol
Formal Charge:
1
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.636g/mol
Monoisotopic Mass:
231.034g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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