Home Carboxys 1-methyl-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid

1-methyl-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid

CAS No.:
26516-28-9
Catalog Number:
AG01A96Q
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
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Product Description
Catalog Number:
AG01A96Q
Chemical Name:
1-methyl-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid
CAS Number:
26516-28-9
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
MDL Number:
MFCD16547661
IUPAC Name:
1-methyl-3,4-dihydro-2H-naphthalene-1-carboxylic acid
InChI:
InChI=1S/C12H14O2/c1-12(11(13)14)8-4-6-9-5-2-3-7-10(9)12/h2-3,5,7H,4,6,8H2,1H3,(H,13,14)
InChI Key:
GKAFAFBEKXKBLN-UHFFFAOYSA-N
SMILES:
OC(=O)C1(C)CCCc2c1cccc2
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.099g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.242g/mol
Monoisotopic Mass:
190.099g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties