Basic information
- CAS
17405-06-0- Standard SMILES
CN(N=O)c1cccc(Br)c1- InChIKey
MMJTUBIBPCYLJO-UHFFFAOYSA-N- Molecular formula
- C7H7BrN2O
- Average molar mass
- 215.05 g/mol
- Monoisotopic mass
- 213.97418
Names & identifiers
- Preferred name
- Aniline, m-bromo-N-methyl-N-nitroso-
- IUPAC
- N-(3-bromophenyl)-N-methylnitrous amide
Names & synonyms
17405-06-03-Bromo-N-methyl-N-nitrosobenzenamineANILINE, m-BROMO-N-METHYL-N-NITROSO-m-Bromo-N-methyl-N-nitrosoanilineBenzenamine, 3-bromo-N-methyl-N-nitroso-NSC 12922BRN 1841688DTXSID501697522-12-00-00343 (Beilstein Handbook Reference)RefChem:319623DTXCID0092243Benzenamine, 3-bromo-N-methyl-N-nitroso-(9CI)
Show more names
3WW7ZC7J36NSC-12922N-(3-bromophenyl)-N-methylnitrous amide(3-Bromophenyl)methylnitrosamineNSC12922UNII-3WW7ZC7J36MFCD01670123SY375859
Database identifiers
- CAS
17405-06-0- PubChem CID
- 28522
- DTXSID
DTXSID50169752- UNII
- 3WW7ZC7J36
- EC Number
- 183-765-4
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 142
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
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P203, P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P318, P319, P321, P330, P332+P317, P337+P317, P361+P364, 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. 3 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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