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3-Toluidine

CAS No.:
108-44-1
Catalog Number:
AG0033SB
Molecular Formula:
C7H9N
Molecular Weight:
107.1531
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%(GC)
In Stock USA
United States
$39
- +
5g
98%(GC)
In Stock USA
United States
$57
- +
25g
98%(GC)
In Stock USA
United States
$87
- +
100g
98%(GC)
In Stock USA
United States
$223
- +
Product Description
Catalog Number:
AG0033SB
Chemical Name:
3-Toluidine
CAS Number:
108-44-1
Molecular Formula:
C7H9N
Molecular Weight:
107.1531
MDL Number:
MFCD00007808
IUPAC Name:
3-methylaniline
InChI:
InChI=1S/C7H9N/c1-6-3-2-4-7(8)5-6/h2-5H,8H2,1H3
InChI Key:
JJYPMNFTHPTTDI-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)N
EC Number:
203-583-1
UNII:
006FKQ96T3
NSC Number:
15349
RTECS Number:
XU2800000
UN Number:
1708
Properties
Complexity:
70.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
107.073g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
107.156g/mol
Monoisotopic Mass:
107.073g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
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Thermal, vibrational and EPR studies of Cu(II) bromide bis(p-methylaniline) and bis(m-methylaniline) complexes. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20040101
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Properties