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Home Other Building Blocks 1,2,3,4-Tetrahydro-1-naphthoic acid

1,2,3,4-Tetrahydro-1-naphthoic acid

CAS No.:
1914-65-4
Catalog Number:
AG002F7N
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$25
- +
25g
98%
In Stock USA
United States
$88
- +
100g
98%
In Stock USA
United States
$275
- +
500g
98%
In Stock USA
United States
$938
- +
Product Description
Catalog Number:
AG002F7N
Chemical Name:
1,2,3,4-Tetrahydro-1-naphthoic acid
CAS Number:
1914-65-4
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
MDL Number:
MFCD02179127
IUPAC Name:
1,2,3,4-tetrahydronaphthalene-1-carboxylic acid
InChI:
InChI=1S/C11H12O2/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7H2,(H,12,13)
InChI Key:
VDLWTJCSPSUGOA-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCCc2c1cccc2
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.084g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
176.215g/mol
Monoisotopic Mass:
176.084g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
Phenethyl nicotinamides, a novel class of Na(V)1.7 channel blockers: structure and activity relationship. Bioorganic & medicinal chemistry letters 20121001
Structure and activity relationship in the (S)-N-chroman-3-ylcarboxamide series of voltage-gated sodium channel blockers. Bioorganic & medicinal chemistry letters 20120901
Combined application of stable carbon isotope analysis and specific metabolites determination for assessing in situ degradation of aromatic hydrocarbons in a tar oil-contaminated aquifer. Environmental science & technology 20040115
Properties