sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks Methyl o-toluate

Methyl o-toluate

CAS No.:
89-71-4
Catalog Number:
AG0036A1
Molecular Formula:
C9H10O2
Molecular Weight:
150.1745
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$19
- +
100g
98%
In Stock USA
United States
$63
- +
500g
98%
In Stock USA
United States
$188
- +
Product Description
Catalog Number:
AG0036A1
Chemical Name:
Methyl o-toluate
CAS Number:
89-71-4
Molecular Formula:
C9H10O2
Molecular Weight:
150.1745
MDL Number:
MFCD00008428
IUPAC Name:
methyl 2-methylbenzoate
InChI:
InChI=1S/C9H10O2/c1-7-5-3-4-6-8(7)9(10)11-2/h3-6H,1-2H3
InChI Key:
WVWZECQNFWFVFW-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccccc1C
EC Number:
201-932-2
UNII:
MC8KDB9FUW
NSC Number:
9402
Properties
Complexity:
143  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.068g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.177g/mol
Monoisotopic Mass:
150.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Literature
Title Journal
Protecting group free synthesis of 6-substituted naphthols and binols. The Journal of organic chemistry 20110401
Glass transition in binary eutectic systems: best glass-forming composition. The journal of physical chemistry. B 20100923
Structural relaxation dynamics in binary glass-forming molecular liquids with ideal and complex mixing behavior. The journal of physical chemistry. B 20100318
Identification of a highly efficient alkylated pincer thioimido-palladium(II) complex as the active catalyst in Negishi coupling. Chemistry (Weinheim an der Bergstrasse, Germany) 20090101
Properties