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Basic information
- CAS
118-13-8- Standard SMILES
O=C(O)c1c(O)cnc2ccccc12- InChIKey
MXNVEJDRXSFZQB-UHFFFAOYSA-N- Molecular formula
- C10H7NO3
- Average molar mass
- 189.17 g/mol
- Monoisotopic mass
- 189.04259309
Names & identifiers
- Preferred name
- 3-Hydroxyquinoline-4-carboxylic acid
- IUPAC
- 3-hydroxyquinoline-4-carboxylic acid
- English name
- 3-HYDROXYQUINOLINE-4-CARBOXYLIC ACID
- Molecular formula
- C10H7NO3
- Molecular weight
- 189.17
Names & synonyms
3-Hydroxyquinoline-4-carboxylic acid3-Hydroxy-4-quinolinecarboxylic acidRefChem:502606204-236-7118-13-83-Hydroxycinchoninic acidCINCHONINIC ACID, 3-HYDROXY-4-Quinolinecarboxylic acid, 3-hydroxy-MFCD015369596QJT7K2GZG3-hydroxy-quinoline-4-carboxylic acid4-Quinolinecarboxylicacid, 3-hydroxy-
Show more names
3-Hydroxycinchoninicacid
EINECS 204-236-7BRN 0154787UNII-6QJT7K2GZGOprea1_4337044-22-00-02296 (Beilstein Handbook Reference)SCHEMBL1759028DTXSID401519893-Hydroxyquinoline-4-carboxylicacid
Database identifiers
- CAS
118-13-8- PubChem CID
- 8352
- DTXSID
DTXSID40151989- UNII
- 6QJT7K2GZG
- EC Number
- 204-236-7
- Nikkaji
- J48.406G
Properties
Computed structural propertiesFilling in
- XLogP
- 1.9
- Topological polar surface area
- 70.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 231
Physicochemical properties
- form
- Solid
- FDA UNII
- 6 QJT7K2GZG · 6QJT7K2GZG
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P271-P280
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22
- HS Code
- 2933499090 · 2933499090
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]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Safety data
- hs_code
- 2933499090
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P271-P280
Chemistry & industry
Applications
Uses3-Hydroxyquinoline-4-carboxylic acid is a useful reactant used for the preparation of benzazepinones and benzoxazepinones as Inhibitor of Apoptosis Proteins (IAPs) antagonists.
Upstream & downstream products
Downstream products
Suppliers26 total
山东玖玥生物科技有限公司15553333686 · [email protected]
咸宁深蓝生物医药研发有限公司18171815831 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
苏州亚衍医药科技有限公司17715136450 · [email protected]
山东万和化学科技有限公司18854132367 · [email protected]
南京环合生物科技有限公司18605270162 · [email protected]
苏州施亚生物科技有限公司86(512)5235 8471 17715136450 · [email protected]
Qingdao Dexin Chemical Co., Ltd+86-15553333686 · [email protected]
上海皓之翔生物科技有限公司（原上海拓青化工有限公司）
Related reactions
1 records
Compound notes
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