Home Carboxys 1-(carboxymethyl)cyclopropane-1-carboxylic acid

1-(carboxymethyl)cyclopropane-1-carboxylic acid

CAS No.:
33229-04-8
Catalog Number:
AG01AE4K
Molecular Formula:
C6H8O4
Molecular Weight:
144.1253
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Product Description
Catalog Number:
AG01AE4K
Chemical Name:
1-(carboxymethyl)cyclopropane-1-carboxylic acid
CAS Number:
33229-04-8
Molecular Formula:
C6H8O4
Molecular Weight:
144.1253
MDL Number:
MFCD19229096
IUPAC Name:
1-(carboxymethyl)cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C6H8O4/c7-4(8)3-6(1-2-6)5(9)10/h1-3H2,(H,7,8)(H,9,10)
InChI Key:
TYHRCGALWHXYOO-UHFFFAOYSA-N
SMILES:
OC(=O)CC1(CC1)C(=O)O
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.042g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
144.126g/mol
Monoisotopic Mass:
144.042g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties