2-iodo-1H-pyrrolo[2,3-b]pyridine
Basic information
- CAS
1227270-32-7- Standard SMILES
Ic1cc2cccnc2[nH]1- InChIKey
MIVORZGIUCOUGC-UHFFFAOYSA-N- Molecular formula
- C7H5IN2
- Average molar mass
- 244.03 g/mol
- Monoisotopic mass
- 243.94975
Names & identifiers
- Preferred name
- 2-iodo-1H-pyrrolo[2,3-b]pyridine
- IUPAC
- 2-iodo-1H-pyrrolo[2,3-b]pyridine
- English name
- 2-Iodo-1H-pyrrolo[2,3-b]pyridine
- Molecular formula
- C7H5IN2
- Molecular weight
- 244.03
Names & synonyms
2-iodo-1H-pyrrolo[2,3-b]pyridine1227270-32-7DTXSID606213562-Iodo-1H-pyrrolo(2,3-b)pyridineRefChem:262149DTXCID40572110862-767-52-IODO-7-AZAINDOLEMFCD168758271H-Pyrrolo[2,3-b]pyridine, 2-iodo-SCHEMBL575029AKOS015920230
Show more names
2-Iodo-1H-pyrrolo[2,3-b]p...
DS-1412PB19490EN300-120008AMY2894A891031SY097784DB-347156F079850
Database identifiers
- CAS
1227270-32-7- PubChem CID
- 21998694
- DTXSID
DTXSID60621356- EC Number
- 862-767-5
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 129
Physicochemical properties
- Density
- 2.082 · 2.082
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- pka
- 12.45 · 12.45±0.40(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 312 · H312-H315-H335-H319-H332-H302
- Precautionary statements
- 261 · P261-P271-P304+P340-P312-P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-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
- H312-H315-H335-H319-H332-H302
- Precautionary statements
- P261-P271-P304+P340-P312-P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
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Compound notes
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