Basic information
- CAS
14068-28-1- Standard SMILES
N#CCc1ccc2ccccc2n1- InChIKey
UNFOICLZNBECOR-UHFFFAOYSA-N- Molecular formula
- C11H8N2
- Average molar mass
- 168.19 g/mol
- Monoisotopic mass
- 168.06874826
Names & identifiers
- Preferred name
- 2-(Quinolin-2-yl)acetonitrile
- IUPAC
- 2-quinolin-2-ylacetonitrile
- English name
- 2-(quinolin-2-yl)acetonitrile
- Molecular formula
- C11H8N2
- Molecular weight
- 168.19
Names & synonyms
2-(quinolin-2-yl)acetonitrile14068-28-1DTXSID30295028RefChem:254770DTXCID80246166874-233-92-Quinolineacetonitrile2-quinolin-2-ylacetonitrileMFCD099241202-(2-Quinolyl)acetonitrile2-(Cyanomethyl)quinoline2-cyanomethylquinoline
Show more names
2-Quinolinylacetonitrile
2-QuinolylacetonitrileQuinolin-2-yl-acetonitrile(Quinolin-2-yl)acetonitrileSCHEMBL1078145CHEMBL4547353UNFOICLZNBECOR-UHFFFAOYSA-NPAA06828AKOS009157561
Database identifiers
- CAS
14068-28-1- PubChem CID
- 264302
- DTXSID
DTXSID30295028- ChEMBL
CHEMBL4547353- EC Number
- 874-233-9
- Nikkaji
- J1.489.580I
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 36.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 215
Physicochemical properties
- storage temp.
- -20 °C · Storage temp. -20°C
- Appearance
- Light yellow to yellow Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H332-H302-H315-H312
- Precautionary statements
- 261 · P261-P271-P304+P340-P312-P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501-P264-P280-P305+P351+P338-P337+P313P-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]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, 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 CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H319-H332-H302-H315-H312
- Precautionary statements
- P261-P271-P304+P340-P312-P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers15 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]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
重庆旭晗科技有限公司13668063927; 13668063927 · [email protected]
上海卡洛化学有限公司21-33526724 18930996265 · [email protected]
上海昶衍化工科技有限公司021-20242659 18930833303 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
上海人兮科技有限公司021-67759270 17717059219 · [email protected]
华诺医药科技(广西)有限公司13005928603 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
Hefei Hirisun Pharmatech Co., Ltd+8615056975894 · [email protected]
Related reactions
7 records
Compound notes
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