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Home > Nitro Compounds > 2941-66-4

2941-66-4

2941-66-4 | 2-Methyl-5-nitrobenzo[d]thiazole

CAS No: 2941-66-4 Catalog No: AG003HNN MDL No:MFCD00602735

Product Description

Catalog Number:
AG003HNN
Chemical Name:
2-Methyl-5-nitrobenzo[d]thiazole
CAS Number:
2941-66-4
Molecular Formula:
C8H6N2O2S
Molecular Weight:
194.2104
MDL Number:
MFCD00602735
IUPAC Name:
2-methyl-5-nitro-1,3-benzothiazole
InChI:
InChI=1S/C8H6N2O2S/c1-5-9-7-4-6(10(11)12)2-3-8(7)13-5/h2-4H,1H3
InChI Key:
VEWGTWPJKSPGCD-UHFFFAOYSA-N
SMILES:
Cc1sc2c(n1)cc(cc2)[N+](=O)[O-]

Properties

Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.015g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.208g/mol
Monoisotopic Mass:
194.015g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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