Home Carboxys 2H-Pyran-4-carboxylicacid, tetrahydro-2-methyl-

2H-Pyran-4-carboxylicacid, tetrahydro-2-methyl-

CAS No.:
88572-21-8
Catalog Number:
AG004BE5
Molecular Formula:
C7H12O3
Molecular Weight:
144.1684
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Product Description
Catalog Number:
AG004BE5
Chemical Name:
2H-Pyran-4-carboxylicacid, tetrahydro-2-methyl-
CAS Number:
88572-21-8
Molecular Formula:
C7H12O3
Molecular Weight:
144.1684
MDL Number:
MFCD01547811
IUPAC Name:
2-methyloxane-4-carboxylic acid
InChI:
InChI=1S/C7H12O3/c1-5-4-6(7(8)9)2-3-10-5/h5-6H,2-4H2,1H3,(H,8,9)
InChI Key:
YKGYMBGOLZPBOL-UHFFFAOYSA-N
SMILES:
CC1OCCC(C1)C(=O)O
Properties
Complexity:
133  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.079g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
144.17g/mol
Monoisotopic Mass:
144.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties