Home Carboxys 3-[1-(2-carboxyethyl)cyclopropyl]propanoic acid

3-[1-(2-carboxyethyl)cyclopropyl]propanoic acid

CAS No.:
1989672-04-9
Catalog Number:
AG01B6KS
Molecular Formula:
C9H14O4
Molecular Weight:
186.2051
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Product Description
Catalog Number:
AG01B6KS
Chemical Name:
3-[1-(2-carboxyethyl)cyclopropyl]propanoic acid
CAS Number:
1989672-04-9
Molecular Formula:
C9H14O4
Molecular Weight:
186.2051
MDL Number:
MFCD30342873
IUPAC Name:
3-[1-(2-carboxyethyl)cyclopropyl]propanoic acid
InChI:
InChI=1S/C9H14O4/c10-7(11)1-3-9(5-6-9)4-2-8(12)13/h1-6H2,(H,10,11)(H,12,13)
InChI Key:
YTNFZCRMQDLXSV-UHFFFAOYSA-N
SMILES:
OC(=O)CCC1(CCC(=O)O)CC1
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.089g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
186.207g/mol
Monoisotopic Mass:
186.089g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties