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122327-85-9 | 2-Thiazolamine, 5-ethenyl-4,5-dihydro-N-phenyl-
CAS No: 122327-85-9 Catalog No: AG00173O MDL No:
Product Description
Catalog Number:
AG00173O
Chemical Name:
2-Thiazolamine, 5-ethenyl-4,5-dihydro-N-phenyl-
CAS Number:
122327-85-9
Molecular Formula:
C11H12N2S
Molecular Weight:
204.2914
IUPAC Name:
5-ethenyl-N-phenyl-4,5-dihydro-1,3-thiazol-2-amine
InChI:
InChI=1S/C11H12N2S/c1-2-10-8-12-11(14-10)13-9-6-4-3-5-7-9/h2-7,10H,1,8H2,(H,12,13)
InChI Key:
HQQCIYSNQIQLBA-UHFFFAOYSA-N
SMILES:
C=CC1CN=C(S1)Nc1ccccc1
Properties
Complexity:
231
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:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.291g/mol
Monoisotopic Mass:
204.072g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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