Home Other Building Blocks 3-(3-oxocyclobutyl)prop-2-ynoic acid

3-(3-oxocyclobutyl)prop-2-ynoic acid

CAS No.:
2090692-68-3
Catalog Number:
AG01BRZY
Molecular Formula:
C7H6O3
Molecular Weight:
138.1207
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Product Description
Catalog Number:
AG01BRZY
Chemical Name:
3-(3-oxocyclobutyl)prop-2-ynoic acid
CAS Number:
2090692-68-3
Molecular Formula:
C7H6O3
Molecular Weight:
138.1207
MDL Number:
MFCD31421168
IUPAC Name:
3-(3-oxocyclobutyl)prop-2-ynoic acid
InChI:
InChI=1S/C7H6O3/c8-6-3-5(4-6)1-2-7(9)10/h5H,3-4H2,(H,9,10)
InChI Key:
VVXMBZNBAMJCSY-UHFFFAOYSA-N
SMILES:
O=C1CC(C1)C#CC(=O)O
Properties
Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.032g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
138.122g/mol
Monoisotopic Mass:
138.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties