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1199-47-9 | Phenol, 2-amino-5-(1,1-dimethylethyl)-
CAS No: 1199-47-9 Catalog No: AG000PUW MDL No:MFCD16996854
Product Description
Catalog Number:
AG000PUW
Chemical Name:
Phenol, 2-amino-5-(1,1-dimethylethyl)-
CAS Number:
1199-47-9
Molecular Formula:
C10H15NO
Molecular Weight:
165.2322
MDL Number:
MFCD16996854
IUPAC Name:
2-amino-5-tert-butylphenol
InChI:
InChI=1S/C10H15NO/c1-10(2,3)7-4-5-8(11)9(12)6-7/h4-6,12H,11H2,1-3H3
InChI Key:
HFCOMOKKPQIADM-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1O)C(C)(C)C
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.115g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
165.236g/mol
Monoisotopic Mass:
165.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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