Home Other Building Blocks 2-(3-tert-butylphenyl)ethan-1-amine

2-(3-tert-butylphenyl)ethan-1-amine

CAS No.:
1000538-58-8
Catalog Number:
AG01A5N6
Molecular Formula:
C12H19N
Molecular Weight:
177.2860
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Product Description
Catalog Number:
AG01A5N6
Chemical Name:
2-(3-tert-butylphenyl)ethan-1-amine
CAS Number:
1000538-58-8
Molecular Formula:
C12H19N
Molecular Weight:
177.2860
MDL Number:
MFCD09924666
IUPAC Name:
2-(3-tert-butylphenyl)ethanamine
InChI:
InChI=1S/C12H19N/c1-12(2,3)11-6-4-5-10(9-11)7-8-13/h4-6,9H,7-8,13H2,1-3H3
InChI Key:
XLZCRVKMGMIMER-UHFFFAOYSA-N
SMILES:
NCCc1cccc(c1)C(C)(C)C
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.152g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
177.291g/mol
Monoisotopic Mass:
177.152g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties