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1247125-23-0 | 2-iodo-N-(1-methoxypropan-2-yl)aniline
CAS No: 1247125-23-0 Catalog No: AG01B13A MDL No:MFCD16787565
Product Description
Catalog Number:
AG01B13A
Chemical Name:
2-iodo-N-(1-methoxypropan-2-yl)aniline
CAS Number:
1247125-23-0
Molecular Formula:
C10H14INO
Molecular Weight:
291.1287
MDL Number:
MFCD16787565
IUPAC Name:
2-iodo-N-(1-methoxypropan-2-yl)aniline
InChI:
InChI=1S/C10H14INO/c1-8(7-13-2)12-10-6-4-3-5-9(10)11/h3-6,8,12H,7H2,1-2H3
InChI Key:
QTLVCRJFBUVXKT-UHFFFAOYSA-N
SMILES:
COCC(Nc1ccccc1I)C
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.012g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
291.132g/mol
Monoisotopic Mass:
291.012g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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