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Home Other Building Blocks Methyl 4-methylbenzoate

Methyl 4-methylbenzoate

CAS No.:
99-75-2
Catalog Number:
AG00357P
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
$50
- +
500g
98%
In Stock USA
United States
$188
- +
Product Description
Catalog Number:
AG00357P
Chemical Name:
Methyl 4-methylbenzoate
CAS Number:
99-75-2
Molecular Formula:
C9H10O2
Molecular Weight:
150.1745
MDL Number:
MFCD00008441
IUPAC Name:
methyl 4-methylbenzoate
InChI:
InChI=1S/C9H10O2/c1-7-3-5-8(6-4-7)9(10)11-2/h3-6H,1-2H3
InChI Key:
QSSJZLPUHJDYKF-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1)C
EC Number:
202-784-1
UNII:
964JP0ZZRG
NSC Number:
24761
Properties
Complexity:
135  
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:
2.7  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Glass transition in binary eutectic systems: best glass-forming composition. The journal of physical chemistry. B 20100923
Methyl 3,5-dibromo-4-methyl-benzoate. Acta crystallographica. Section E, Structure reports online 20100401
Methyl 4-methyl-benzoate. Acta crystallographica. Section E, Structure reports online 20080501
Factors affecting the selectivity of the oxidation of methyl p-toluate by cobalt(III). Inorganic chemistry 20080317
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties