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1799421-08-1 | 4-tert-Butyl-2-iodoaniline HCl
CAS No: 1799421-08-1 Catalog No: AG00HZZH MDL No:MFCD26792534
Product Description
Catalog Number:
AG00HZZH
Chemical Name:
4-tert-Butyl-2-iodoaniline HCl
CAS Number:
1799421-08-1
Molecular Formula:
C10H15ClIN
Molecular Weight:
311.5903
MDL Number:
MFCD26792534
IUPAC Name:
4-tert-butyl-2-iodoaniline;hydrochloride
InChI:
InChI=1S/C10H14IN.ClH/c1-10(2,3)7-4-5-9(12)8(11)6-7;/h4-6H,12H2,1-3H3;1H
InChI Key:
FIXCAAFRTIWKJX-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1I)C(C)(C)C.Cl
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.994g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
311.591g/mol
Monoisotopic Mass:
310.994g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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