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Home > Thiazole > 1160264-31-2
1160264-31-2 | 1-(4-Methyl-1,3-thiazol-2-yl)azepane
CAS No: 1160264-31-2 Catalog No: AG00HDMS MDL No:MFCD12197733
Product Description
Catalog Number:
AG00HDMS
Chemical Name:
1-(4-Methyl-1,3-thiazol-2-yl)azepane
CAS Number:
1160264-31-2
Molecular Formula:
C10H16N2S
Molecular Weight:
196.3124
MDL Number:
MFCD12197733
IUPAC Name:
2-(azepan-1-yl)-4-methyl-1,3-thiazole
InChI:
InChI=1S/C10H16N2S/c1-9-8-13-10(11-9)12-6-4-2-3-5-7-12/h8H,2-7H2,1H3
InChI Key:
PRQXADOOORIULT-UHFFFAOYSA-N
SMILES:
Cc1csc(n1)N1CCCCCC1
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.103g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.312g/mol
Monoisotopic Mass:
196.103g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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