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23000-14-8 | 4-Oxazolecarboxylic acid, 2,5-dimethyl-
CAS No: 23000-14-8 Catalog No: AG002LTF MDL No:MFCD03011595
Product Description
Catalog Number:
AG002LTF
Chemical Name:
4-Oxazolecarboxylic acid, 2,5-dimethyl-
CAS Number:
23000-14-8
Molecular Formula:
C6H7NO3
Molecular Weight:
141.1247
MDL Number:
MFCD03011595
IUPAC Name:
2,5-dimethyl-1,3-oxazole-4-carboxylic acid
InChI:
InChI=1S/C6H7NO3/c1-3-5(6(8)9)7-4(2)10-3/h1-2H3,(H,8,9)
InChI Key:
LHGRUGVXZLHYKE-UHFFFAOYSA-N
SMILES:
Cc1oc(c(n1)C(=O)O)C
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.043g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
141.126g/mol
Monoisotopic Mass:
141.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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