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73402-80-9 | N-(TERT-BUTYL)-3-PHENYL-2-PROPYN-1-AMINE
CAS No: 73402-80-9 Catalog No: AG005EE6 MDL No:MFCD07405535
Product Description
Catalog Number:
AG005EE6
Chemical Name:
N-(TERT-BUTYL)-3-PHENYL-2-PROPYN-1-AMINE
CAS Number:
73402-80-9
Molecular Formula:
C13H17N
Molecular Weight:
187.2808
MDL Number:
MFCD07405535
IUPAC Name:
2-methyl-N-(3-phenylprop-2-ynyl)propan-2-amine
InChI:
InChI=1S/C13H17N/c1-13(2,3)14-11-7-10-12-8-5-4-6-9-12/h4-6,8-9,14H,11H2,1-3H3
InChI Key:
TXVWAFWRJIHFKG-UHFFFAOYSA-N
SMILES:
CC(NCC#Cc1ccccc1)(C)C
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.136g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.286g/mol
Monoisotopic Mass:
187.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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