Home Carboxys spiro[3.3]heptane-2,2-dicarboxylic acid

spiro[3.3]heptane-2,2-dicarboxylic acid

CAS No.:
64775-97-9
Catalog Number:
AG01AF3W
Molecular Formula:
C9H12O4
Molecular Weight:
184.1892
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AF3W
Chemical Name:
spiro[3.3]heptane-2,2-dicarboxylic acid
CAS Number:
64775-97-9
Molecular Formula:
C9H12O4
Molecular Weight:
184.1892
MDL Number:
MFCD20641103
IUPAC Name:
spiro[3.3]heptane-2,2-dicarboxylic acid
InChI:
InChI=1S/C9H12O4/c10-6(11)9(7(12)13)4-8(5-9)2-1-3-8/h1-5H2,(H,10,11)(H,12,13)
InChI Key:
OSNPFTFAUNVQMS-UHFFFAOYSA-N
SMILES:
OC(=O)C1(CC2(C1)CCC2)C(=O)O
NSC Number:
115095
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.074g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
184.191g/mol
Monoisotopic Mass:
184.074g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties