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114219-87-3 | 4H-1,4-Oxaphosphorin, 4-chloro-, 4-oxide
CAS No: 114219-87-3 Catalog No: AG000AUW MDL No:
Product Description
Catalog Number:
AG000AUW
Chemical Name:
4H-1,4-Oxaphosphorin, 4-chloro-, 4-oxide
CAS Number:
114219-87-3
Molecular Formula:
C4H4ClO2P
Molecular Weight:
150.5001
IUPAC Name:
4-chloro-1,4λ5-oxaphosphinine 4-oxide
InChI:
InChI=1S/C4H4ClO2P/c5-8(6)3-1-7-2-4-8/h1-4H
InChI Key:
IBNAEVZDYLTYRN-UHFFFAOYSA-N
SMILES:
ClP1(=O)C=COC=C1
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.964g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.498g/mol
Monoisotopic Mass:
149.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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