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1039963-95-5 | N-(butan-2-yl)-2-iodoaniline
CAS No: 1039963-95-5 Catalog No: AG01AYG4 MDL No:MFCD11194360
Product Description
Catalog Number:
AG01AYG4
Chemical Name:
N-(butan-2-yl)-2-iodoaniline
CAS Number:
1039963-95-5
Molecular Formula:
C10H14IN
Molecular Weight:
275.1293
MDL Number:
MFCD11194360
IUPAC Name:
N-butan-2-yl-2-iodoaniline
InChI:
InChI=1S/C10H14IN/c1-3-8(2)12-10-7-5-4-6-9(10)11/h4-8,12H,3H2,1-2H3
InChI Key:
VSRUNRWDVQWNMO-UHFFFAOYSA-N
SMILES:
CCC(Nc1ccccc1I)C
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.017g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
275.133g/mol
Monoisotopic Mass:
275.017g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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