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Basic information
- CAS
67752-28-7- Standard SMILES
O=C(O)CCc1cnc2ccccc2c1- InChIKey
PDVKRIXEUOTSJQ-UHFFFAOYSA-N- Molecular formula
- C12H11NO2
- Average molar mass
- 201.22 g/mol
- Monoisotopic mass
- 201.07897859
Names & identifiers
- Preferred name
- 3-(Quinolin-3-yl)propanoic acid
- IUPAC
- 3-quinolin-3-ylpropanoic acid
- English name
- 3-(Quinolin-3-yl)propanoic acid
- Molecular formula
- C12H11NO2
- Molecular weight
- 201.22
Names & synonyms
3-(QUINOLIN-3-YL)PROPANOIC ACID67752-28-73-Quinolinepropanoic acidDTXSID10497240RefChem:496162DTXCID10448050849-696-5MFCD110407433-quinolin-3-ylpropanoic acid3-Quinolin-3-yl-propionic acidquinoline-3-propionic acid3-(3-quinolyl)propanoic acid
Show more names
3-(quinolin-3-yl)propanoic acid(WXC06905)
SCHEMBL28463473-(3-quinolinyl)propanoic acidPDVKRIXEUOTSJQ-UHFFFAOYSA-NSCA75228AKOS015151575SB711773-(QUINOLIN-3-YL)PROPANOICACIDAS-60630
Database identifiers
- CAS
67752-28-7- PubChem CID
- 12415751
- DTXSID
DTXSID10497240- EC Number
- 849-696-5
- Nikkaji
- J2.123.018I
Properties
Computed structural propertiesFilling in
- XLogP
- 1.9
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 230
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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)
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%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H335-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers15 total
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
台州南峰药物研究所[email protected] 13127117265 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
济南睿遥明志医疗科技有限公司15662630077 15662630077 · [email protected]
北京建强伟业科技有限公司（FUSION弗珍试剂品牌）0531-88924771 15614660963 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
上海炎泽化工有限公司15345144255 19901447308 · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
河南阿尔法化工有限公司0371-55055611 18137792234 · [email protected]
安徽敬同药业股份有限公司13675155016 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
6 records
Compound notes
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