Home Other Building Blocks 3-cycloheptylpropanoic acid

3-cycloheptylpropanoic acid

CAS No.:
4448-78-6
Catalog Number:
AG01B2J8
Molecular Formula:
C10H18O2
Molecular Weight:
170.2487
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Product Description
Catalog Number:
AG01B2J8
Chemical Name:
3-cycloheptylpropanoic acid
CAS Number:
4448-78-6
Molecular Formula:
C10H18O2
Molecular Weight:
170.2487
MDL Number:
MFCD11554146
IUPAC Name:
3-cycloheptylpropanoic acid
InChI:
InChI=1S/C10H18O2/c11-10(12)8-7-9-5-3-1-2-4-6-9/h9H,1-8H2,(H,11,12)
InChI Key:
SWSZSSZIIGQTIZ-UHFFFAOYSA-N
SMILES:
OC(=O)CCC1CCCCCC1
Properties
Complexity:
135  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.131g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.252g/mol
Monoisotopic Mass:
170.131g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties