Basic information
- CAS
85-06-3- Standard SMILES
Cc1ccc2c(ccc3ccccc32)n1- InChIKey
SUHRSZJZYUCLOD-UHFFFAOYSA-N- Molecular formula
- C14H11N
- Average molar mass
- 193.24 g/mol
- Monoisotopic mass
- 193.08914936
Names & identifiers
- Preferred name
- 3-Methylbenzo(f)quinoline
- IUPAC
- 3-methylbenzo[f]quinoline
- English name
- 3-METHYLBENZO-5,6-QUINOLINE
- Molecular formula
- C14H11N
- Molecular weight
- 193.24
Names & synonyms
3-Methylbenzo[f]quinolineBenzo[f]quinoline, 3-methyl-beta-NaphthoquinaldineBenzo(f)quinoline, 3-methyl-.beta.-Naphthoquinaldine3-METHYLBENZO(F)QUINOLINEJ67OCR12XNNSC-4999EINECS 201-584-1NSC 43316NSC-43316UNII-J67OCR12XN
Show more names
-Naphthochinaldin5,6-BENZOQUINALDINEB-NAPHTHOQUINALDINE2-methyl-5,6-benzoquinoline3-Methylbenzo[f]quinoline in isooctane
DTXSID7058917RefChem:94835DTXCID3048443201-584-1SUHRSZJZYUCLOD-UHFFFAOYSA-N85-06-33-Methylbenzo-5,6-quinolineNSC4999
Database identifiers
- CAS
85-06-3- PubChem CID
- 6797
- DTXSID
DTXSID7058917- UNII
- J67OCR12XN
- EC Number
- 201-584-1
- Nikkaji
- J4.908E
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 225
Physicochemical properties
- Melting point
- 73 · 73-78°C
- Boiling point
- 214 · 214-215 °C(Press: 21 Torr)
- Density
- 1.155 · 1.155
- storage temp.
- 2 · 2-8°C
- pka
- 5.92 · 5.92±0.40(Predicted)
- Water Solubility
- Slightly soluble in water.
- FDA UNII
- 67 OCR12XN · J67OCR12XN
- EPA Substance Registry System
- 3 · Benzo[f]quinoline, 3-methyl- (85-06-3)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- Safety Statements
- 22 · 22-24/25
- 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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzo[f]quinoline, 3-methyl-: ACTIVE
Upstream & downstream products
Downstream products
Suppliers18 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
雷丁试剂0510-85629785 18013409632 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…