Home Halogens Benzene, 1-chloro-2-(methoxymethyl)-4-nitro-

Benzene, 1-chloro-2-(methoxymethyl)-4-nitro-

CAS No.:
101513-52-4
Catalog Number:
AG00H9HF
Molecular Formula:
C8H8ClNO3
Molecular Weight:
201.6070
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Product Description
Catalog Number:
AG00H9HF
Chemical Name:
Benzene, 1-chloro-2-(methoxymethyl)-4-nitro-
CAS Number:
101513-52-4
Molecular Formula:
C8H8ClNO3
Molecular Weight:
201.6070
MDL Number:
MFCD11645996
IUPAC Name:
1-chloro-2-(methoxymethyl)-4-nitrobenzene
InChI:
InChI=1S/C8H8ClNO3/c1-13-5-6-4-7(10(11)12)2-3-8(6)9/h2-4H,5H2,1H3
InChI Key:
DFVKPXXXKCFXAX-UHFFFAOYSA-N
SMILES:
COCc1cc(ccc1Cl)[N+](=O)[O-]
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.019g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.606g/mol
Monoisotopic Mass:
201.019g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties