1,2-Dichloro-4-(dibutoxyphosphorylmethyl)benzene
Basic information
- CAS
74038-40-7- Standard SMILES
CCCCOP(=O)(Cc1ccc(Cl)c(Cl)c1)OCCCC- InChIKey
VQXIGOHNFWMFLY-UHFFFAOYSA-N- Molecular formula
- C15H23Cl2O3P
- Average molar mass
- 353.2 g/mol
- Monoisotopic mass
- 352.076187
Names & identifiers
- Preferred name
- 1,2-Dichloro-4-(dibutoxyphosphorylmethyl)benzene
- IUPAC
- 1,2-dichloro-4-(dibutoxyphosphorylmethyl)benzene
- English name
- (3,4-Dichlorobenzyl)phosphonic acid dibutyl ester
- Molecular weight
- 0
Names & synonyms
74038-40-71,2-dichloro-4-(dibutoxyphosphorylmethyl)benzenePhosphonic acid, (3,4-dichlorobenzyl)-, dibutyl esterNSC-20307072952M87G6DTXSID20224887RefChem:1052246DTXCID50147378Dibutyl (3,4-dichlorobenzyl)phosphonateDi-N-butyl (3,4-dichlorobenzyl) phosphate77341-01-6Dibutyl 3,4-dichlorobenzylphosphonate
Show more names
(3,4-Dichlorobenzyl)phosphonic acid dibutyl ester
NSC 203070dibutyl [(3,4-dichlorophenyl)methyl]phosphonateUNII-72952M87G6WLN: GR BG D1PO&O4&O4Phosphonic acid, ((3,4-dichlorophenyl)methyl)-, dibutyl esterNSC203070Phosphonic acid,4-dichlorobenzyl)-, dibutyl esterPhosphonic acid,4-dichlorophenyl)methyl]-, dibutyl ester
Database identifiers
- CAS
74038-40-7- PubChem CID
- 99255
- DTXSID
DTXSID20224887- UNII
- 72952M87G6
- Nikkaji
- J85.635E
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 314
Physicochemical properties
- FDA UNII
- 72952 M87G6 · 72952M87G6
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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