4-Cyano-7-chloro-Saaindole
Basic information
- CAS
1082040-97-8- Standard SMILES
N#Cc1ncc(Cl)c2[nH]ccc12- InChIKey
PHKAKWAUMDGXQD-UHFFFAOYSA-N- Molecular formula
- C8H4ClN3
- Average molar mass
- 177.59 g/mol
- Monoisotopic mass
- 177.0093748
Names & identifiers
- Preferred name
- 4-Cyano-7-chloro-Saaindole
- IUPAC
- 7-chloro-1H-pyrrolo[3,2-c]pyridine-4-carbonitrile
- English name
- 1H-Pyrrolo[3,2-c]pyridine-4-carbonitrile, 7-chloro-
- Molecular formula
- C8H4ClN3
- Molecular weight
- 177.59
Names & synonyms
1082040-97-8RefChem:5222324-Cyano-7-chloro-Saaindole850-117-37-chloro-1H-pyrrolo[3,2-c]pyridine-4-carbonitrile4-Cyano-7-chloro-5-azaindoleAKOS025149548DB-2060161H-Pyrrolo[3,2-c]pyridine-4-carbonitrile, 7-chloro-
Database identifiers
- CAS
1082040-97-8- PubChem CID
- 53399461
- EC Number
- 850-117-3
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 52.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 222
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H315-H302
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-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, 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
- H319-H335-H315-H302
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
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Related reactions
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Compound notes
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