200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1224869-02-6
1224869-02-6 | 2H-Thiopyran-4-acetic acid, tetrahydro-, 1,1-dioxide
CAS No: 1224869-02-6 Catalog No: AG0017AH MDL No:MFCD11045819
Product Description
Catalog Number:
AG0017AH
Chemical Name:
2H-Thiopyran-4-acetic acid, tetrahydro-, 1,1-dioxide
CAS Number:
1224869-02-6
Molecular Formula:
C7H12O4S
Molecular Weight:
192.2328
MDL Number:
MFCD11045819
IUPAC Name:
2-(1,1-dioxothian-4-yl)acetic acid
InChI:
InChI=1S/C7H12O4S/c8-7(9)5-6-1-3-12(10,11)4-2-6/h6H,1-5H2,(H,8,9)
InChI Key:
ZNKGPJTYNUEAKE-UHFFFAOYSA-N
SMILES:
OC(=O)CC1CCS(=O)(=O)CC1
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.046g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.229g/mol
Monoisotopic Mass:
192.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.