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69492-91-7

69492-91-7 | 2-Iodo-4-methyl-6-nitrophenol

CAS No: 69492-91-7 Catalog No: AG005XQS MDL No:MFCD00060537

Product Description

Catalog Number:
AG005XQS
Chemical Name:
2-Iodo-4-methyl-6-nitrophenol
CAS Number:
69492-91-7
Molecular Formula:
C7H6INO3
Molecular Weight:
279.0319
MDL Number:
MFCD00060537
IUPAC Name:
2-iodo-4-methyl-6-nitrophenol
InChI:
InChI=1S/C7H6INO3/c1-4-2-5(8)7(10)6(3-4)9(11)12/h2-3,10H,1H3
InChI Key:
ZGSKNXKQYFZYAW-UHFFFAOYSA-N
SMILES:
Cc1cc(I)c(c(c1)[N+](=O)[O-])O

Properties

Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.939g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
279.033g/mol
Monoisotopic Mass:
278.939g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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