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1304513-50-5 | Propanoic acid, 3,3',3''-phosphinidynetris-, 1,1',1''-trimethyl ester, hydrochloride (1:1)
CAS No: 1304513-50-5 Catalog No: AG000UG3 MDL No:
Product Description
Catalog Number:
AG000UG3
Chemical Name:
Propanoic acid, 3,3',3''-phosphinidynetris-, 1,1',1''-trimethyl ester, hydrochloride (1:1)
CAS Number:
1304513-50-5
Molecular Formula:
C12H22ClO6P
Molecular Weight:
328.7262
IUPAC Name:
methyl 3-bis(3-methoxy-3-oxopropyl)phosphanylpropanoate;hydrochloride
InChI:
InChI=1S/C12H21O6P.ClH/c1-16-10(13)4-7-19(8-5-11(14)17-2)9-6-12(15)18-3;/h4-9H2,1-3H3;1H
InChI Key:
WTQICRWGUQSICN-UHFFFAOYSA-N
SMILES:
COC(=O)CCP(CCC(=O)OC)CCC(=O)OC.Cl
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.084g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
328.726g/mol
Monoisotopic Mass:
328.084g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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