Basic information
- CAS
60538-98-9- Standard SMILES
Cc1ccc2nc(-c3ccccc3)cc(C(=O)O)c2c1- InChIKey
QTHANKFZSPYAPO-UHFFFAOYSA-N- Molecular formula
- C17H13NO2
- Average molar mass
- 263.29 g/mol
- Monoisotopic mass
- 263.09462866
Names & identifiers
- Preferred name
- 6-Methyl-2-phenylquinoline-4-carboxylic acid
- IUPAC
- 6-methyl-2-phenylquinoline-4-carboxylic acid
- English name
- 6-METHYL-2-PHENYL-QUINOLINE-4-CARBOXYLIC ACID
- Molecular formula
- C17H13NO2
- Molecular weight
- 263.29
Names & synonyms
6-methyl-2-phenylquinoline-4-carboxylic acid60538-98-9DTXSID10351378RefChem:308976DTXCID90302444857-700-16-Methyl-2-phenyl-quinoline-4-carboxylic acid6-methyl-2-phenyl-4-quinolinecarboxylic acidMFCD00487545Oprea1_429962Oprea1_584920CBDivE_008151
Show more names
6-methyl-2-phenyl-cinchoninic acid4-QUINOLINECARBOXYLIC ACID,6-METHYL-2-PHENYL-
MLS000105729SCHEMBL1898810CHEMBL1506781QTHANKFZSPYAPO-UHFFFAOYSA-NHMS2397L16ALBB-000134BBL036995STK390162
Database identifiers
- CAS
60538-98-9- PubChem CID
- 698707
- DTXSID
DTXSID10351378- ChEMBL
CHEMBL1506781- EC Number
- 857-700-1
- Nikkaji
- J2.132.636D
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 351
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H315
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H335-H315
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers5 total
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
HBCChem, Inc.+1-510-219-6317 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
菏泽书颖生物科技有限公司18553078733 · [email protected]
Related reactions
1 records
Compound notes
Loading…