Home Other Building Blocks (4-tert-butyl-1,3-thiazol-2-yl)(phenyl)methanamine

(4-tert-butyl-1,3-thiazol-2-yl)(phenyl)methanamine

CAS No.:
1017250-43-9
Catalog Number:
AG01A9NQ
Molecular Formula:
C14H18N2S
Molecular Weight:
246.3711
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Product Description
Catalog Number:
AG01A9NQ
Chemical Name:
(4-tert-butyl-1,3-thiazol-2-yl)(phenyl)methanamine
CAS Number:
1017250-43-9
Molecular Formula:
C14H18N2S
Molecular Weight:
246.3711
MDL Number:
MFCD09891459
IUPAC Name:
(4-tert-butyl-1,3-thiazol-2-yl)-phenylmethanamine
InChI:
InChI=1S/C14H18N2S/c1-14(2,3)11-9-17-13(16-11)12(15)10-7-5-4-6-8-10/h4-9,12H,15H2,1-3H3
InChI Key:
TWIMODLZVAEOIS-UHFFFAOYSA-N
SMILES:
NC(c1scc(n1)C(C)(C)C)c1ccccc1
Properties
Complexity:
243  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.119g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
246.372g/mol
Monoisotopic Mass:
246.119g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties