Basic information
- CAS
2314-30-9- Standard SMILES
N#Cc1cc(I)cc(I)c1O- InChIKey
FNNNLVLLTDINFG-UHFFFAOYSA-N- Molecular formula
- C7H3I2NO
- Average molar mass
- 370.91 g/mol
- Monoisotopic mass
- 370.83041
Names & identifiers
- Preferred name
- Benzonitrile, 2-hydroxy-3,5-diiodo-
- IUPAC
- 2-hydroxy-3,5-diiodobenzonitrile
- English name
- Benzonitrile, 2-hydroxy-3,5-diiodo-
- Molecular formula
- C7H3I2NO
- Molecular weight
- 370.91
Names & synonyms
2-hydroxy-3,5-diiodobenzonitrile2314-30-9Benzonitrile, 2-hydroxy-3,5-diiodo-2-hydroxy-3,5-diiodo-benzonitrileSCHEMBL7103109DTXSID80469873MFCD22055672CS-0373235
Database identifiers
- CAS
2314-30-9- PubChem CID
- 11639302
- DTXSID
DTXSID80469873
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 44 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 188
Experimental & physicochemical properties
LogP4.1
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers8 total
常州鑫研合医药科技有限公司0519-85252752 15366845260 · [email protected]
河南普赛化工产品有限公司0371-60919097 15378766539 · [email protected]
上海珂华生物科技有限公司021-58581007 18019463053 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
陕西国槐硕海医药科技有限公司029-13279368192 13279368192 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
郑州浩创新材料有限公司19139721821; 19139721821 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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