200,000+ products from a single source!
sales@angenechem.com
876716-61-9 | (TETRAHYDRO-2H-PYRAN-2-YLMETHOXY)ACETIC ACID
CAS No: 876716-61-9 Catalog No: AG004H65 MDL No:MFCD07643237
Product Description
Catalog Number:
AG004H65
Chemical Name:
(TETRAHYDRO-2H-PYRAN-2-YLMETHOXY)ACETIC ACID
CAS Number:
876716-61-9
Molecular Formula:
C8H14O4
Molecular Weight:
174.1944
MDL Number:
MFCD07643237
IUPAC Name:
2-(oxan-2-ylmethoxy)acetic acid
InChI:
InChI=1S/C8H14O4/c9-8(10)6-11-5-7-3-1-2-4-12-7/h7H,1-6H2,(H,9,10)
InChI Key:
DHQDMQIHHQMTMU-UHFFFAOYSA-N
SMILES:
OC(=O)COCC1CCCCO1
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.089g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.196g/mol
Monoisotopic Mass:
174.089g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.