Cas no 24630-66-8 (Phosphonic acid,(hydroxymethyl)-, dibutyl ester (8CI,9CI))
24630-66-8 structure
Product Name:Phosphonic acid,(hydroxymethyl)-, dibutyl ester (8CI,9CI)
CAS No:24630-66-8
MF:C9H21O4P
MW:224.234404325485
CID:274959
PubChem ID:240271
Update Time:2025-04-19
Phosphonic acid,(hydroxymethyl)-, dibutyl ester (8CI,9CI) Chemical and Physical Properties
Names and Identifiers
-
- Phosphonic acid,(hydroxymethyl)-, dibutyl ester (8CI,9CI)
- dibutoxyphosphorylmethanol
- dibutyl (hydroxymethyl)phosphonate
- dibutyl (hydroxymethyl)-phosphonate
- dibutyl hydroxymethylphosphonate
- hydroxymethyl-phosphonic acid dibutyl ester
- Hydroxymethylphosphonic acid dibutyl ester
- DTXSID50947557
- SCHEMBL2479030
- 24630-66-8
- NSC46365
- NSC-46365
-
- Inchi： 1S/C9H21O4P/c1-3-5-7-12-14(11,9-10)13-8-6-4-2/h10H,3-9H2,1-2H3
- InChI Key： WNLPQGMKIVUYEB-UHFFFAOYSA-N
- SMILES： P(CO)(=O)(OCCCC)OCCCC
Computed Properties
- Exact Mass: 224.11783
- Monoisotopic Mass: 224.11774614g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 9
- Complexity: 158
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.4
- Topological Polar Surface Area: 55.8?2
Experimental Properties
- PSA: 55.76
- LogP: 2.76270
Phosphonic acid,(hydroxymethyl)-, dibutyl ester (8CI,9CI) Related Literature
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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