Home Bromides 82842-52-2
82842-52-2,MFCD00015476
Catalog No.:AA003IX4
82842-52-2 | 3-Bromo-2,4,6-trimethylaniline
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$43.00   $30.00
- +
5g
98%
in stock  
$120.00   $84.00
- +
25g
98%
in stock  
$459.00   $322.00
  • Technical Information
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Technical Information
Catalog Number:
AA003IX4
Chemical Name:
3-Bromo-2,4,6-trimethylaniline
CAS Number:
82842-52-2
Molecular Formula:
C9H12BrN
Molecular Weight:
214.1023
MDL Number:
MFCD00015476
IUPAC Name:
3-bromo-2,4,6-trimethylaniline
InChI:
InChI=1S/C9H12BrN/c1-5-4-6(2)9(11)7(3)8(5)10/h4H,11H2,1-3H3
InChI Key:
MVLMPTBHZPYDBZ-UHFFFAOYSA-N
SMILES:
Nc1c(C)cc(c(c1C)Br)C
Properties
Computed Properties
 
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.015g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
214.106g/mol
Monoisotopic Mass:
213.015g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

Synonyms
 
3-Bromo-2,4,6-trimethylaniline 
82842-52-2 
CTK3J6283 
ZINC57055 
DTXSID30350868 
2,4,6-Trimethyl-3-bromoaniline 
3-bromo-2,4,6-trimethyl-aniline 
ACT11550 
2804AC 
3-bromo-2,4,6-trimethylbenzenamine 
3-bromo-2,4,6-trimethylphenylamine 
ANW-66602 
Benzenamine, 3-bromo-2,4,6-trimethyl- 
3-Bromo-2,4,6-trimethyl-phenylamine 
AKOS015834143 
AC-3725 
AM62111 
AS05310 
CM11341 
MCULE-1768944736 
RTR-025878 
VZ35012 
KS-000011F0 
MVLMPTBHZPYDBZ-UHFFFAOYSA-N 
3-Bromo-2,4,6-trimethylaniline, 98% 
AJ-09555 
AK-36486 
AN-12711 
BC002768 
CJ-00434 
ZB001944 
3-Bromo-2,4,6-trimethylaniline, 98+% 
TR-025878 
B3849 
MFCD00015476 
FT-0615134 
ST50319724 
A19790 
I14-49729 
InChI=1/C9H12BrN/c1-5-4-6(2)9(11)7(3)8(5)10/h4H,11H2,1-3H 
C9H12BrN 
CID688300 
ZINC00057055 
PubChem4363 
AC1LELS9 
AC1Q2HRY 
KSC496E8H 
SCHEMBL532944 
Literature
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