Basic information
- CAS
71642-16-5- Standard SMILES
Cc1c(Br)cc(Br)c(N)c1Br- InChIKey
KDZKZKWJNMBNAP-UHFFFAOYSA-N- Molecular formula
- C7H6Br3N
- Average molar mass
- 343.84 g/mol
- Monoisotopic mass
- 340.80503549
Names & identifiers
- Preferred name
- 3-Methyl-2,4,6-tribromoaniline
- IUPAC
- 2,4,6-tribromo-3-methylaniline
- English name
- 3-METHYL-2,4,6-TRIBROMOANILINE
- Molecular formula
- C7H6Br3N
- Molecular weight
- 343.84
Names & synonyms
3-Methyl-2,4,6-tribromoaniline71642-16-52,4,6-tribromo-3-methylanilineMFCD000147683-Amino-2,4,6-tribromotoluene3-Methyl-2,4,6-tribrom-anilinNSC86671NCIOpen2_009427SCHEMBL4007556DTXSID302218872,4,6-tribromo-3-methyl-aniline2,4,6-tribromo-3-methylphenylamine
Show more names
2,4,6-TRIBROMO-M-TOLUIDINE3-METHL-2,4,6-TRIBROMOANILINE5-Methyl-2,4,6-tribromobenzenamine3-Methyl-2,4,6-tribromoaniline, 98+%2,4,6-TribroMo-3-Methylaniline, 98+%Benzenamine, 2,4,6-tribromo-3-methyl-2,4,6-Tribromo-3-methylaniline~2,4,6-Tribromo-m-toluidine
NSC 86671NSC-86671AKOS003619038FA67543DB-055557CS-0191955ST50408554A10411
Database identifiers
- CAS
71642-16-5- PubChem CID
- 144499
- DTXSID
DTXSID30221887- Nikkaji
- J257.631G
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 142
Physicochemical properties
- Melting point
- 101 · 101-102°C
- Boiling point
- 314.1 · 314.1±37.0 °C(Predicted)
- Density
- 2.196 · 2.196±0.06 g/cm3(Predicted)
- pka
- -0.11 · -0.11±0.10(Predicted)
- BRN
- 3252610 · 3252610
- 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
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
- HS Code
- 2921420090 · 2921420090
Safety & regulation
Safety data
- hs_code
- 2921420090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 26-36/37/39
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Applications
Uses3-Methyl-2,4,6-tribromoaniline is an aniline derivative that can be used in pharmaceutical synthesis and as a raw material for flame retardants and antioxidants.
Upstream & downstream products
Downstream products
Suppliers9 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
南京代盟化工有限公司02566880956 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
2 records
Compound notes
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