Home Carboxys 1-(methoxymethyl)cyclohex-3-ene-1-carboxylic acid

1-(methoxymethyl)cyclohex-3-ene-1-carboxylic acid

CAS No.:
1934407-34-7
Catalog Number:
AG01EM41
Molecular Formula:
C9H14O3
Molecular Weight:
170.2057
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Product Description
Catalog Number:
AG01EM41
Chemical Name:
1-(methoxymethyl)cyclohex-3-ene-1-carboxylic acid
CAS Number:
1934407-34-7
Molecular Formula:
C9H14O3
Molecular Weight:
170.2057
MDL Number:
MFCD29956533
IUPAC Name:
1-(methoxymethyl)cyclohex-3-ene-1-carboxylic acid
InChI:
InChI=1S/C9H14O3/c1-12-7-9(8(10)11)5-3-2-4-6-9/h2-3H,4-7H2,1H3,(H,10,11)
InChI Key:
PSOANQZOUIMUAK-UHFFFAOYSA-N
SMILES:
COCC1(CCC=CC1)C(=O)O
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.094g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.208g/mol
Monoisotopic Mass:
170.094g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties