5,5-Bis{bis[(propan-2-yl)oxy]phosphoryl}pentanoic acid

HCID 21842002

Notes Reactions

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Basic information

CAS: 184225-09-0
Standard SMILES: CC(C)OP(=O)(OC(C)C)C(CCCC(=O)O)P(=O)(OC(C)C)OC(C)C
InChIKey: BCMAWZGIQJXYGF-UHFFFAOYSA-N
Molecular formula: C17H36O8P2
Average molar mass: 430.4 g/mol
Monoisotopic mass: 430.1885421

Names & identifiers

Preferred name: 5,5-Bis{bis[(propan-2-yl)oxy]phosphoryl}pentanoic acid
IUPAC: 5,5-bis[di(propan-2-yloxy)phosphoryl]pentanoic acid

Names & synonyms

184225-09-0SCHEMBL53278765,5-Bis{bis[(propan-2-yl)oxy]phosphoryl}pentanoic acidDTXSID30618713BCMAWZGIQJXYGF-UHFFFAOYSA-N5,5-bis(diisopropoxyphosphinoyl)valeric acid

Database identifiers

CAS: 184225-09-0
PubChem CID: 21842002
DTXSID: DTXSID30618713

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 108 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 8
Rotatable bonds: 14
Heavy atoms: 27
Formal charge: 0
Complexity: 479

Related reactions

1 records

New reaction record

HRID 1737285As productuspto-grants-1999_10

Compound notes

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