Basic information
- CAS
4076-40-8- Standard SMILES
Cc1cccc2c1ccc1ccc3ccccc3c12- InChIKey
SBDIEAITSKXPKN-UHFFFAOYSA-N- Molecular formula
- C19H14
- Average molar mass
- 242.3 g/mol
- Monoisotopic mass
- 242.10955045
Names & identifiers
- Preferred name
- 4-Methylbenzo[c]phenanthrene
- IUPAC
- 4-methylbenzo[c]phenanthrene
- English name
- 4-METHYLBENZO[C]PHENANTHRENE
- Molecular formula
- C19H14
- Molecular weight
- 242.31
Names & synonyms
4-Methylbenzo[c]phenanthrene4-METHYLBENZO(C)PHENANTHRENERefChem:525548660-718-04076-40-88-Methyl-3:4-benzphenanthreneBENZO(c)PHENANTHRENE, 4-METHYL-Benzo[c]phenanthrene, 4-methyl-BT6W9424UJBRN 23294284-Methyl-3,4-benzophenanthreneUNII-BT6W9424UJ
Show more names
4-Methylbenzo[c]phenanthrene@50 μg/mL in Toluene
8-Methyl-3,4-benzphenanthren4-Methylbenzo[c]phenanthrene #DTXSID10193750SBDIEAITSKXPKN-UHFFFAOYSA-NAKOS024340893
Database identifiers
- CAS
4076-40-8- PubChem CID
- 20008
- DTXSID
DTXSID10193750- UNII
- BT6W9424UJ
- EC Number
- 660-718-0
- Nikkaji
- J54.528G
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 320
Experimental & physicochemical properties
SpringerMaterials PropertiesAngular frequency
Physicochemical properties
- Melting point
- 65.5 °C · 65.5°C
- Boiling point
- 320.14 °C · 320.14°C (rough estimate)
- Density
- 1.1011 · 1.1011 (estimate)
- refractive index
- 1.475 · 1.4750 (estimate)
- FDA UNII
- 6 W9424UJ · BT6W9424UJ
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 410 · H410-H302
- Precautionary statements
- 273 · P273-P391-P501-P264-P270-P301+P312-P330-P501
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H410-H302
- Precautionary statements
- P273-P391-P501-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers4 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
上海甄准生物科技有限公司15800340161 · [email protected]
SIGMAALDRICH—
AccuStandard Inc[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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