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Home Nitros 1-(Chloromethyl)-3-nitrobenzene

1-(Chloromethyl)-3-nitrobenzene

CAS No.:
619-23-8
Catalog Number:
AG003D2V
Molecular Formula:
C7H6ClNO2
Molecular Weight:
171.5810
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$25
- +
25g
98%
In Stock USA
United States
$60
- +
100g
98%
In Stock USA
United States
$188
- +
Product Description
Catalog Number:
AG003D2V
Chemical Name:
1-(Chloromethyl)-3-nitrobenzene
CAS Number:
619-23-8
Molecular Formula:
C7H6ClNO2
Molecular Weight:
171.5810
MDL Number:
MFCD00007272
IUPAC Name:
1-(chloromethyl)-3-nitrobenzene
InChI:
InChI=1S/C7H6ClNO2/c8-5-6-2-1-3-7(4-6)9(10)11/h1-4H,5H2
InChI Key:
APGGSERFJKEWFG-UHFFFAOYSA-N
SMILES:
ClCc1cccc(c1)[N+](=O)[O-]
EC Number:
210-586-1
UNII:
OJL133898O
NSC Number:
9802
UN Number:
3261
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.009g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.58g/mol
Monoisotopic Mass:
171.009g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
1-Chloro-meth-yl-3-nitro-benzene. Acta crystallographica. Section E, Structure reports online 20100301
Microfluidic channel flow cell for simultaneous cryoelectrochemical electron spin resonance. Analytical chemistry 20070301
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties