Basic information
- CAS
606-34-8- Standard SMILES
O=Cc1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-]- InChIKey
HWFUMAYINFTNSZ-UHFFFAOYSA-N- Molecular formula
- C7H3N3O7
- Average molar mass
- 241.11 g/mol
- Monoisotopic mass
- 240.99709944
Names & identifiers
- Preferred name
- Benzaldehyde, 2,4,6-trinitro-
- IUPAC
- 2,4,6-trinitrobenzaldehyde
- English name
- 2,4,6-TRINITROBENZALDEHYDE
- Molecular formula
- C7H3N3O7
- Molecular weight
- 241.11
Names & synonyms
2,4,6-Trinitrobenzaldehyde606-34-8Benzaldehyde, 2,4,6-trinitro-EINECS 210-114-4NSC 89301DTXSID1060550RefChem:117100DTXCID3042841210-114-4TNBALBenzaldehyde,2,4,6-trinitro-2,6-Trinitrobenzaldehyde
Show more names
SALOR-INT L170291-1EA2,4,6-TRINITROBENZOIC ALDEHIDEsodium (4-aminophenyl)sulfonyl-(4-methyl-2-thiazolyl)azanide
Benzaldehyde,4,6-trinitro-SCHEMBL2824579SCHEMBL7348266HWFUMAYINFTNSZ-UHFFFAOYSA-NNSC89301NSC-89301STK683794AKOS003626681
Database identifiers
- CAS
606-34-8- PubChem CID
- 69074
- DTXSID
DTXSID1060550- EC Number
- 210-114-4
- Nikkaji
- J105.237C
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 155 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 330
Physicochemical properties
- Boiling point
- 383.88 °C · 383.88°C (rough estimate)
- Density
- 1.8304 · 1.8304 (rough estimate)
- refractive index
- 1.55 · 1.5500 (estimate)
- EPA Substance Registry System
- 2 · Benzaldehyde, 2,4,6-trinitro- (606-34-8)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- TSCA
- TSCA listed
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 (97.4%): 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 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (97.4%)
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H315-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzaldehyde, 2,4,6-trinitro-: INACTIVE
Suppliers5 total
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
武汉泰易成生化药业有限公司027-88320699 ;15307126061 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…