Basic information
- CAS
7570-45-8- Standard SMILES
CCn1c2ccccc2c2cc(C=O)ccc21- InChIKey
QGJXVBICNCIWEL-UHFFFAOYSA-N- Molecular formula
- C15H13NO
- Average molar mass
- 223.27 g/mol
- Monoisotopic mass
- 223.09971404
Names & identifiers
- Preferred name
- 9-ethyl-9H-carbazole-3-carbaldehyde
- IUPAC
- 9-ethylcarbazole-3-carbaldehyde
- English name
- N-Ethyl-3-carbazolecarboxaldehyde
- Molecular formula
- C15H13NO
- Molecular weight
- 223.27
Names & synonyms
Show more names
Database identifiers
- CAS
7570-45-8- PubChem CID
- 82055
- DTXSID
DTXSID10226613- UNII
- ZVF6H6ZPE4
- EC Number
- 231-471-2
- Nikkaji
- J60.953F
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 22 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 291
Physicochemical properties
- Melting point
- 85 · 85-87 °C (lit.)
- Boiling point
- 255 °C · 255 °C / 15mmHg
- Density
- 1.0707 · 1.0707 (rough estimate)
- refractive index
- 1.55 · 1.5500 (estimate)
- storage temp.
- 2 · 2-8°C
- solubility
- soluble in Benzene,Toluene
- form
- Crystalline Powder or Granules
- color
- Yellow to ochre
- InChI
- 1S/C15H13NO/c1-2-16-14-6-4-3-5-12(14)13-9-11(10-17)7-8-15(13)16/h3-10H,2H2,1H3
- InChIKey
- QGJXVBICNCIWEL-UHFFFAOYSA-N
- SMILES
- [H]C(=O)c1ccc2n(CC)c3ccccc3c2c1
- CAS DataBase Reference
- 7570 · 7570-45-8(CAS DataBase Reference)
- FDA UNII
- 6 H6ZPE4 · ZVF6H6ZPE4
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H319
- Precautionary statements
- 264 · P264-P270-P280-P301+P312-P305+P351+P338-P337+P313
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xn,Xi
- Risk Statements
- 22 · 22-36
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
- HS Code
- 29339900 · 29339900
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 4 OralEye · Acute Tox. 4 OralEye Irrit. 2
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (97.6%): Harmful if swallowed [Warning Acute toxicity, oral];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Not Classified
Hazard information
Regulatory information
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- hs_code
- 29339900
- risk_code
- 22-36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn,Xi
- safety_code
- 26-36
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H319
- Hazard Classifications
- Acute Tox. 4 OralEye Irrit. 2
- Precautionary statements
- P264-P270-P280-P301+P312-P305+P351+P338-P337+P313
Chemistry & industry
Applications
Uses9-Ethyl-3-carbazolecarboxaldehyde was used in the synthesis of poly(vinyl acetal)s (PVAcs).
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
Related reactions
Compound notes
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