Basic information
- CAS
56795-92-7- Standard SMILES
O=Cc1c[nH]c2cnc(OCc3ccccc3)cc12- InChIKey
OZWLZROTVDCROC-UHFFFAOYSA-N- Molecular formula
- C15H12N2O2
- Average molar mass
- 252.27 g/mol
- Monoisotopic mass
- 252.08987763
Names & identifiers
- Preferred name
- 5-(Benzyloxy)-1H-pyrrolo[2,3-c]pyridine-3-carbaldehyde
- IUPAC
- 5-phenylmethoxy-1H-pyrrolo[2,3-c]pyridine-3-carbaldehyde
- English name
- 5-Benzyloxy-1H-pyrrolo(2,3-c)pyridine-3- carboxaldehyde, 97
- Molecular formula
- C15H12N2O2
- Molecular weight
- 252.27
Names & synonyms
5-(Benzyloxy)-1H-pyrrolo[2,3-c]pyridine-3-carbaldehyde56795-92-75-phenylmethoxy-1H-pyrrolo[2,3-c]pyridine-3-carbaldehyde5-benzyloxy-1H-pyrrolo[2,3-c]pyridine-3-carbaldehydeMFCD001917845-benzyloxy-6-azaindole-3-carboxaldehydeSCHEMBL1418984DTXSID60408482AKOS015892304AS-40177ST50825951F212066
Show more names
5-(benzylo×y)-1H-pyrrolo[2,3-c]pyridine-3-carbaldehyde5-Benzyloxy-1H-pyrrolo(2,3-c)pyridine-3- carboxaldehyde, 975-(Phenylmethoxy)-1H-pyrrolo[2,3-c]pyridine-3-carboxaldehyde1H-Pyrrolo[2,3-c]pyridine-3-carboxaldehyde, 5-(phenylmethoxy)-
5-(phenylmethoxy)pyrrolo[2,3-c]pyridine-3-carbaldehyde
Database identifiers
- CAS
56795-92-7- PubChem CID
- 5114536
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 55 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 305
Physicochemical properties
- Melting point
- 194 · 194-198 °C(lit.)
- Boiling point
- 479.5 · 479.5±40.0 °C(Predicted)
- Density
- 1.317 · 1.317
- storage temp.
- 2 · 2-8°C
- pka
- 12.79 · 12.79±0.40(Predicted)
- Sensitive
- Air Sensitive
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
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]
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)
Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Safety data
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Suppliers14 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海景颜化工科技有限公司13817811078 · [email protected]
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
杭州扬德医药科技有限公司0571-81953185 +86-15381198709 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
越林试剂021-62960152 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
江西弗莱医药科技有限公司15870833005 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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