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Home Other Building Blocks 4-Methylbenzoyl chloride

4-Methylbenzoyl chloride

CAS No.:
874-60-2
Catalog Number:
AG0035JI
Molecular Formula:
C8H7ClO
Molecular Weight:
154.5936
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
- +
Product Description
Catalog Number:
AG0035JI
Chemical Name:
4-Methylbenzoyl chloride
CAS Number:
874-60-2
Molecular Formula:
C8H7ClO
Molecular Weight:
154.5936
MDL Number:
MFCD00000696
IUPAC Name:
4-methylbenzoyl chloride
InChI:
InChI=1S/C8H7ClO/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3
InChI Key:
NQUVCRCCRXRJCK-UHFFFAOYSA-N
SMILES:
ClC(=O)c1ccc(cc1)C
EC Number:
212-864-8
UNII:
092E36PWL4
Properties
Complexity:
125  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.019g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.593g/mol
Monoisotopic Mass:
154.019g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Literature
Title Journal
2-Methyl-3-(2-methyl-phen-yl)-4-oxo-3,4-dihydro-quinazolin-8-yl 4-methyl-benzoate. Acta crystallographica. Section E, Structure reports online 20120301
N-{3-[2-(4-Fluoro-phen-oxy)eth-yl]-2,4-dioxo-1,3-diaza-spiro-[4.5]decan-7-yl}-4-methyl-benzamide. Acta crystallographica. Section E, Structure reports online 20110601
2-(4-tert-Butyl-phen-yl)-5-p-tolyl-1,3,4-oxadiazole. Acta crystallographica. Section E, Structure reports online 20100101
2-{3,4-Dibut-oxy-5-[5-(3-methyl-phen-yl)-1,3,4-oxadiazol-2-yl]thio-phen-2-yl}-5-(3-methyl-phen-yl)-1,3,4-oxadiazole. Acta crystallographica. Section E, Structure reports online 20090301
Methyl 4-(4-methyl-benzamido)-2-sulfamoylbenzoate. Acta crystallographica. Section E, Structure reports online 20081201
Synthesis of 5- and 6-carboxy-X-rhodamines. Organic letters 20081106
Properties