Basic information
- CAS
7564-51-4- Standard SMILES
CC1=CCP(=O)(c2ccccc2)C1- InChIKey
DBZGWWBWDYGSRA-UHFFFAOYSA-N- Molecular formula
- C11H13OP
- Average molar mass
- 192.19 g/mol
- Monoisotopic mass
- 192.07040203
Names & identifiers
- Preferred name
- 1H-Phosphole, 2,5-dihydro-3-methyl-1-phenyl-, 1-oxide
- IUPAC
- 3-methyl-1-phenyl-2,5-dihydro-1λ5-phosphole 1-oxide
- English name
- 3-Methyl-1-phenyl-3-phospholene 1-oxide
- Molecular formula
- C11H13OP
- Molecular weight
- 192.19
Names & synonyms
7564-51-43-Methyl-1-phenyl-3-phospholene 1-oxide1H-Phosphole, 2,5-dihydro-3-methyl-1-phenyl-, 1-oxide2,5-Dihydro-3-methyl-1-phenyl-1H-phosphole 1-oxide2,5-Dihydro-3-methyl-1-phenylphosphole-1-oxideEINECS 231-463-9NSC 33505AI3-62678DTXSID808844062,5-Dihydrophosphole, 3-methyl-1-oxo-1-phenyl-RefChem:79915DTXCID201023847
Show more names
2,5-Dihydro-3-methyl-1-phenylphosphol-1-oxide2,5-DIHYDRO-3-METHYL-1-PHENYLPHOSPHOLE 1-OXIDE2,5-dihydro-3-methyl-1-phenyl-1h-phosphol1-oxide2,5-Dihydro-3-methyl-1-phenyl-1H-phosphole,1-oxide
231-463-9DBZGWWBWDYGSRA-UHFFFAOYSA-N3-Methyl-1-phenyl-2,5-dihydro-1H-phosphole 1-oxide1-Phenyl-3-methyl-1-oxo-3-phospholine3-methyl-1-phenyl-2,5-dihydro-1lambda5-phosphole 1-oxideMFCD000404553-Methyl-1-phenyl-2,5-dihydro-phosphole 1-oxide3-Phospholene, 3-methyl-1-phenyl-, 1-oxide
Database identifiers
- CAS
7564-51-4- PubChem CID
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 261
Physicochemical properties
- Melting point
- 61 · 61-65 °C
- Boiling point
- 174 °C0.7 · 174 °C0.7 mm Hg(lit.)
- Density
- 1.11 · 1.11±0.1 g/cm3(Predicted)
- EPA Substance Registry System
- 1 H-Phosphole, · 1H-Phosphole, 2,5-dihydro-3-methyl-1-phenyl-, 1-oxide (7564-51-4)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
- Safety Statements
- 22 · 22-24/25
- WGK Germany
- 3 · 3
- F
- 3 · 3-9
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 33.3% (1 of 3) of reports.
Warning
H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (33.3%)
Safety data
- F
- 3-9
- wgk
- 3
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- Hazard statements
- H315-H335-H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1H-Phosphole, 2,5-dihydro-3-methyl-1-phenyl-, 1-oxide: ACTIVE
Upstream & downstream products
Downstream products
Suppliers16 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
湖北成海化工有限公司027-59220433 18327245847 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
广东翁江化学试剂有限公司0751-2815987 13927875076 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 13651849907 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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