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6326-42-7 | 2-Iodo-4-nitro-benzoic acid Methyl ester
CAS No: 6326-42-7 Catalog No: AG00EKCC MDL No:MFCD00277928
Product Description
Catalog Number:
AG00EKCC
Chemical Name:
2-Iodo-4-nitro-benzoic acid Methyl ester
CAS Number:
6326-42-7
MDL Number:
MFCD00277928
IUPAC Name:
methyl 2-iodo-4-nitrobenzoate
InChI:
InChI=1S/C8H6INO4/c1-14-8(11)6-3-2-5(10(12)13)4-7(6)9/h2-4H,1H3
InChI Key:
KRAIRAIRCFXHRZ-UHFFFAOYSA-N
NSC Number:
30634
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.934g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.043g/mol
Monoisotopic Mass:
306.934g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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