Home Other Building Blocks 3-p-Tolylpropanoic acid

3-p-Tolylpropanoic acid

CAS No.:
1505-50-6
Catalog Number:
AG001MNT
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
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
$107
- +
100g
98%
In Stock USA
United States
$350
- +
Product Description
Catalog Number:
AG001MNT
Chemical Name:
3-p-Tolylpropanoic acid
CAS Number:
1505-50-6
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
MDL Number:
MFCD00016561
IUPAC Name:
3-(4-methylphenyl)propanoic acid
InChI:
InChI=1S/C10H12O2/c1-8-2-4-9(5-3-8)6-7-10(11)12/h2-5H,6-7H2,1H3,(H,11,12)
InChI Key:
LDYGRLNSOKABMM-UHFFFAOYSA-N
SMILES:
OC(=O)CCc1ccc(cc1)C
EC Number:
216-132-9
NSC Number:
512
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.084g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
164.204g/mol
Monoisotopic Mass:
164.084g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties