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156336-41-3 | Phosphonic acid, P-(1-aminopentyl)-, diphenyl ester
CAS No: 156336-41-3 Catalog No: AG001OPC MDL No:
Product Description
Catalog Number:
AG001OPC
Chemical Name:
Phosphonic acid, P-(1-aminopentyl)-, diphenyl ester
CAS Number:
156336-41-3
Molecular Formula:
C17H22NO3P
Molecular Weight:
319.3352
IUPAC Name:
1-diphenoxyphosphorylpentan-1-amine
InChI:
InChI=1S/C17H22NO3P/c1-2-3-14-17(18)22(19,20-15-10-6-4-7-11-15)21-16-12-8-5-9-13-16/h4-13,17H,2-3,14,18H2,1H3
InChI Key:
CTOWVYVHRPJNAZ-UHFFFAOYSA-N
SMILES:
CCCCC(P(=O)(Oc1ccccc1)Oc1ccccc1)N
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.134g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
319.341g/mol
Monoisotopic Mass:
319.134g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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