Basic information
- CAS
54986-63-9- Standard SMILES
Cc1cc2cc(C)c3ccccc3c2c2ccccc12- InChIKey
PKNNRYLZAYRCOT-UHFFFAOYSA-N- Molecular formula
- C20H16
- Average molar mass
- 256.3 g/mol
- Monoisotopic mass
- 256.12520051
Names & identifiers
- Preferred name
- AR-G51 5,8-Dimethylbenzo(C)phenanthrene
- IUPAC
- 5,8-dimethylbenzo[c]phenanthrene
- English name
- 5,8-Dimethylbenzo[c]phenanthrene
- Molecular formula
- C20H16
- Molecular weight
- 256.34
Names & synonyms
RefChem:558497AR-G51 5,8-Dimethylbenzo(C)phenanthrene662-947-15,8-Dimethylbenzo[c]phenanthrene54986-63-9Benzo[c]phenanthrene, 5,8-dimethyl-Benzo(c)phenanthrene, 5,8-dimethyl-SCHEMBL18643640DTXSID60970336PKNNRYLZAYRCOT-UHFFFAOYSA-N5,8-dimethylbenzo[c]-phenanthrene5,8-Dimethylbenzo[c]phenanthrene #
Show more names
5,8-Dimethylbenzo[c]phenanthrene@50 μg/mL in Toluene
AKOS024341219AR-G51 5,8-DIMETHYLBENZO(C)PHENANTHRENE
Database identifiers
- CAS
54986-63-9- PubChem CID
- 94573
- DTXSID
DTXSID60970336- EC Number
- 662-947-1
- Nikkaji
- J103.325E
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
- 20
- Formal charge
- 0
- Complexity
- 314
Physicochemical properties
- Boiling point
- 334.58 °C · 334.58°C (rough estimate)
- Density
- 1.084 · 1.0840 (estimate)
- refractive index
- 1.729 · 1.7290 (estimate)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 413 · H413-H302
- Precautionary statements
- 264 · 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, 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
- Hazard statements
- H413-H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
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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