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247235-78-5 | 2-Thiazolemethanamine, N-(phenylmethyl)-
CAS No: 247235-78-5 Catalog No: AG002P8S MDL No:MFCD06740600
Product Description
Catalog Number:
AG002P8S
Chemical Name:
2-Thiazolemethanamine, N-(phenylmethyl)-
CAS Number:
247235-78-5
Molecular Formula:
C11H12N2S
Molecular Weight:
204.2914
MDL Number:
MFCD06740600
IUPAC Name:
1-phenyl-N-(1,3-thiazol-2-ylmethyl)methanamine
InChI:
InChI=1S/C11H12N2S/c1-2-4-10(5-3-1)8-12-9-11-13-6-7-14-11/h1-7,12H,8-9H2
InChI Key:
UFWSEPMUQJPVBS-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CNCc1nccs1
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.072g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.291g/mol
Monoisotopic Mass:
204.072g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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