200,000+ products from a single source!
sales@angenechem.com
Home > Thiazole > 1496256-67-7
1496256-67-7 | 6-methyl-1,4-thiazepan-1-one
CAS No: 1496256-67-7 Catalog No: AG01BE6W MDL No:MFCD21725073
Product Description
Catalog Number:
AG01BE6W
Chemical Name:
6-methyl-1,4-thiazepan-1-one
CAS Number:
1496256-67-7
Molecular Formula:
C6H13NOS
Molecular Weight:
147.2385
MDL Number:
MFCD21725073
IUPAC Name:
6-methyl-1,4-thiazepane 1-oxide
InChI:
InChI=1S/C6H13NOS/c1-6-4-7-2-3-9(8)5-6/h6-7H,2-5H2,1H3
InChI Key:
CCWAFGCTNZKBQD-UHFFFAOYSA-N
SMILES:
CC1CNCCS(=O)C1
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.072g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
147.236g/mol
Monoisotopic Mass:
147.072g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
48.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.