Home Carboxys Spiro[2.5]octane-5-carboxylic acid

Spiro[2.5]octane-5-carboxylic acid

CAS No.:
1314390-66-3
Catalog Number:
AG00HSGR
Molecular Formula:
C9H14O2
Molecular Weight:
154.2063
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Product Description
Catalog Number:
AG00HSGR
Chemical Name:
Spiro[2.5]octane-5-carboxylic acid
CAS Number:
1314390-66-3
Molecular Formula:
C9H14O2
Molecular Weight:
154.2063
MDL Number:
MFCD20230621
IUPAC Name:
spiro[2.5]octane-7-carboxylic acid
InChI:
InChI=1S/C9H14O2/c10-8(11)7-2-1-3-9(6-7)4-5-9/h7H,1-6H2,(H,10,11)
InChI Key:
ZOQQTCPUNHQTIR-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCCC2(C1)CC2
Properties
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.099g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
154.209g/mol
Monoisotopic Mass:
154.099g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties