Home Nitros 2-Methyl-3-nitrobenzyl chloride

2-Methyl-3-nitrobenzyl chloride

CAS No.:
60468-54-4
Catalog Number:
AG00IAPB
Molecular Formula:
C8H8ClNO2
Molecular Weight:
185.6076
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Purity
Availability
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Price(USD)
Quantity
  
5g
In Stock USA
United States
$255
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Product Description
Catalog Number:
AG00IAPB
Chemical Name:
2-Methyl-3-nitrobenzyl chloride
CAS Number:
60468-54-4
Molecular Formula:
C8H8ClNO2
Molecular Weight:
185.6076
MDL Number:
MFCD00007165
IUPAC Name:
1-(chloromethyl)-2-methyl-3-nitrobenzene
InChI:
InChI=1S/C8H8ClNO2/c1-6-7(5-9)3-2-4-8(6)10(11)12/h2-4H,5H2,1H3
InChI Key:
XZNDXQGZPOZITR-UHFFFAOYSA-N
SMILES:
ClCc1cccc(c1C)[N+](=O)[O-]
EC Number:
262-249-3
Properties
Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.024g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.607g/mol
Monoisotopic Mass:
185.024g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties