Basic information
- CAS
20691-83-2- Standard SMILES
COc1cccc(N=Nc2ccc(N(C)C)cc2)c1- InChIKey
BGKFVSREYGJGDU-UHFFFAOYSA-N- Molecular formula
- C15H17N3O
- Average molar mass
- 255.31 g/mol
- Monoisotopic mass
- 255.13716217
Names & identifiers
- Preferred name
- 4-(Dimethylamino)-3'-methoxyazobenzene
- IUPAC
- 4-[(3-methoxyphenyl)diazenyl]-N,N-dimethylaniline
- English name
- 4-(Dimethylamino)-3'-methoxyazobenzene
- Molecular formula
- C15H17N3O
- Molecular weight
- 255.32
Names & synonyms
4-(DIMETHYLAMINO)-3'-METHOXYAZOBENZENERefChem:515937661-981-4N,N-Dimethyl-p-(3-methoxyphenylazo)aniline20691-83-24-((3-Methoxyphenyl)azo)-N,N-dimethylaniline4-[(3-Methoxyphenyl)azo]-N,N-dimethylaniline3'-Methoxy-4-dimethylaminoazobenzeneNSC 108310BRN 1842934NSC108310ANILINE, N,N-DIMETHYL-p-(3-METHOXYPHENYLAZO)-
Show more names
Aniline, p-((m-methoxyphenyl)azo)-N,N-dimethyl-Benzenamine, 4-((3-methoxyphenyl)azo)-N,N-dimethyl-SCHEMBL2681633DTXSID501037744NSC-108310DS-002093Benzenamine, 4-[2-(3-methoxyphenyl)diazenyl]-N,N-dimethyl-
Database identifiers
- CAS
20691-83-2- PubChem CID
- 30229
- DTXSID
DTXSID501037744- EC Number
- 661-981-4
- Nikkaji
- J33.823K
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 37.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 285
Physicochemical properties
- Boiling point
- 398.55 °C · 398.55°C (rough estimate)
- Density
- 1.0736 · 1.0736 (rough estimate)
- refractive index
- 1.56 · 1.5600 (estimate)
- pka
- 3.29 · 3.29±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 413 · H413-H317-H315-H335-H319-H302
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-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, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H413-H317-H315-H335-H319-H302
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…