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84697-13-2 | (4-(tert-Butoxy)phenyl)methanamine
CAS No: 84697-13-2 Catalog No: AG004SNI MDL No:MFCD06213869
Product Description
Catalog Number:
AG004SNI
Chemical Name:
(4-(tert-Butoxy)phenyl)methanamine
CAS Number:
84697-13-2
Molecular Formula:
C11H17NO
Molecular Weight:
179.2588
MDL Number:
MFCD06213869
IUPAC Name:
[4-[(2-methylpropan-2-yl)oxy]phenyl]methanamine
InChI:
InChI=1S/C11H17NO/c1-11(2,3)13-10-6-4-9(8-12)5-7-10/h4-7H,8,12H2,1-3H3
InChI Key:
HOKKUMFXFSCQHJ-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)OC(C)(C)C
EC Number:
283-723-6
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.131g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.263g/mol
Monoisotopic Mass:
179.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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