Basic information
- CAS
152322-41-3- Standard SMILES
CC(C)OP(C)(=O)Oc1ccc([N+](=O)[O-])cc1- InChIKey
YSHVIWJFWCEDSQ-UHFFFAOYSA-N- Molecular formula
- C10H14NO5P
- Average molar mass
- 259.2 g/mol
- Monoisotopic mass
- 259.06095954
Names & identifiers
- Preferred name
- 1-Methylethyl 4-nitrophenyl P-methylphosphonate
- IUPAC
- 1-[methyl(propan-2-yloxy)phosphoryl]oxy-4-nitrobenzene
- English name
- 4-nitrophenyl 2-propylmethylphosphonate
- Molecular formula
- C10H14NO5P
- Molecular weight
- 259.2
Names & synonyms
3735-97-54-Nitrophenyl 2-propylmethylphosphonateDTXSID4012453181-Methylethyl 4-nitrophenyl P-methylphosphonateDTXSID20275753IMN-4-NO2PhRefChem:907701DTXCID10227140DTXCID10876213isopropyl (4-nitrophenyl) methylphosphonateMFCD010992521-[methyl(propan-2-yloxy)phosphoryl]oxy-4-nitrobenzene
Show more names
Methylphosphonic acid isopropyl p-nitrophenyl esterMethylphosphonic acid isopropyl=4-nitrophenyl esterMethylphosphonic acid isopropyl=(4-nitrophenyl) esterPhosphonic acid, P-methyl-, 1-methylethyl 4-nitrophenyl ester
Isopropyl p-nitrophenyl methylphosphonate4-nitrophenyl propan-2-yl methylphosphonateYSHVIWJFWCEDSQ-UHFFFAOYSA-NBRN 2220854p-Nitrophenyl isopropyl methylphosphonateSCHEMBL1898027Phosphonic acid, methyl-, isopropyl p-nitrophenyl esterPhosphonic acid, methyl-, 1-methylethyl 4-nitrophenyl ester
Database identifiers
- CAS
152322-41-3、3735-97-5- PubChem CID
- 77324
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 81.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 306
Physicochemical properties
- Boiling point
- 136 °C · 136 °C(Press: 0.40 Torr)
- Density
- 1.26 · 1.260±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers6 total
韶远科技（上海）有限公司4000665055 · [email protected]
上海颖心实验室设备有限公司021-021-59178156 15300768757 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
Accela ChemBio Inc.+1-858-6993322 +86-18019713315 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
上海鼓臣生物技术有限公司021-34675735 19147740836 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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