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87989-75-1 | Phosphonic acid, (butoxymethyl)-, 3-chloropropyl ethyl ester
CAS No: 87989-75-1 Catalog No: AG004OQJ MDL No:
Product Description
Catalog Number:
AG004OQJ
Chemical Name:
Phosphonic acid, (butoxymethyl)-, 3-chloropropyl ethyl ester
CAS Number:
87989-75-1
Molecular Formula:
C10H22ClO4P
Molecular Weight:
272.7060
IUPAC Name:
1-[[3-chloropropoxy(ethoxy)phosphoryl]methoxy]butane
InChI:
InChI=1S/C10H22ClO4P/c1-3-5-8-13-10-16(12,14-4-2)15-9-6-7-11/h3-10H2,1-2H3
InChI Key:
WQNQTVUSJDRYMN-UHFFFAOYSA-N
SMILES:
CCCCOCP(=O)(OCCCCl)OCC
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.094g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.706g/mol
Monoisotopic Mass:
272.094g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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