Home Carboxys tricyclo[5.2.1.0,2,6]decane-2-carboxylic acid

tricyclo[5.2.1.0,2,6]decane-2-carboxylic acid

CAS No.:
148810-36-0
Catalog Number:
AG01ABO6
Molecular Formula:
C11H16O2
Molecular Weight:
180.2435
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Product Description
Catalog Number:
AG01ABO6
Chemical Name:
tricyclo[5.2.1.0,2,6]decane-2-carboxylic acid
CAS Number:
148810-36-0
Molecular Formula:
C11H16O2
Molecular Weight:
180.2435
MDL Number:
MFCD20639658
IUPAC Name:
tricyclo[5.2.1.02,6]decane-2-carboxylic acid
InChI:
InChI=1S/C11H16O2/c12-10(13)11-5-1-2-9(11)7-3-4-8(11)6-7/h7-9H,1-6H2,(H,12,13)
InChI Key:
BPPVMMLQNBPNBD-UHFFFAOYSA-N
SMILES:
OC(=O)C12CCCC2C2CC1CC2
Properties
Complexity:
261  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.115g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
180.247g/mol
Monoisotopic Mass:
180.115g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
4  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties