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3420-40-4 | N-(3,4,5,6-TETRAHYDRO-1,3-THIAZIN-2-YLIDENE)ANILINE
CAS No: 3420-40-4 Catalog No: AG00CZMJ MDL No:MFCD00957213
Product Description
Catalog Number:
AG00CZMJ
Chemical Name:
N-(3,4,5,6-TETRAHYDRO-1,3-THIAZIN-2-YLIDENE)ANILINE
CAS Number:
3420-40-4
Molecular Formula:
C10H12N2S
Molecular Weight:
192.2807
MDL Number:
MFCD00957213
IUPAC Name:
N-phenyl-5,6-dihydro-4H-1,3-thiazin-2-amine
InChI:
InChI=1S/C10H12N2S/c1-2-5-9(6-3-1)12-10-11-7-4-8-13-10/h1-3,5-6H,4,7-8H2,(H,11,12)
InChI Key:
ITMNZMYUHMBOMN-UHFFFAOYSA-N
SMILES:
C1CN/C(=N\c2ccccc2)/SC1
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.072g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.28g/mol
Monoisotopic Mass:
192.072g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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