Cas no 500024-27-1 (Methyl 2-cyano-3-methylbenzoate)

Methyl 2-cyano-3-methylbenzoate is a versatile organic compound featuring a cyano group and a methyl ester functionality on a substituted benzene ring. This structure makes it a valuable intermediate in synthetic organic chemistry, particularly in the preparation of pharmaceuticals, agrochemicals, and specialty chemicals. The presence of both electron-withdrawing (cyano) and electron-donating (methyl) groups enhances its reactivity in nucleophilic substitution and condensation reactions. Its ester group allows for further derivatization, while the cyano group can be hydrolyzed or reduced for additional functionalization. The compound is typically used in controlled environments due to its sensitivity to moisture and strong bases. Proper handling and storage are recommended to maintain stability.
Methyl 2-cyano-3-methylbenzoate structure
500024-27-1 structure
Product Name:Methyl 2-cyano-3-methylbenzoate
CAS No:500024-27-1
MF:C10H9NO2
MW:175.183962583542
MDL:MFCD18399106
CID:1543150
PubChem ID:22343213
Update Time:2025-06-08

Methyl 2-cyano-3-methylbenzoate Chemical and Physical Properties

Names and Identifiers

    • Methyl 2-cyano-3-methylbenzoate
    • 3-Methyl-2-cyanobenzoic acid Methyl ester
    • 2-cyano-3-methyl-benzoic acid methyl ester
    • OINKWIOPYXLZJJ-UHFFFAOYSA-N
    • NE23611
    • AK167211
    • MDL： MFCD18399106
    • Inchi： 1S/C10H9NO2/c1-7-4-3-5-8(9(7)6-11)10(12)13-2/h3-5H,1-2H3
    • InChI Key： OINKWIOPYXLZJJ-UHFFFAOYSA-N
    • SMILES： O(C)C(C1=CC=CC(C)=C1C#N)=O

Computed Properties

  • Exact Mass: 175.06337
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 241
  • Topological Polar Surface Area: 50.1

Experimental Properties

  • PSA: 50.09

Methyl 2-cyano-3-methylbenzoate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI XIAN DING Biotechnology Co., Ltd.
B-OU968-250mg
Methyl 2-cyano-3-methylbenzoate
 500024-27-1 98+%
250mg
 532CNY 2021-05-08
SHANG HAI XIAN DING Biotechnology Co., Ltd.
B-OU968-100mg
Methyl 2-cyano-3-methylbenzoate
 500024-27-1 98+%
100mg
 253CNY 2021-05-08
SHANG HAI XIAN DING Biotechnology Co., Ltd.
B-OU968-1g
Methyl 2-cyano-3-methylbenzoate
 500024-27-1 98+%
1g
 546.0CNY 2021-07-12
Chemenu
CM131434-1g
methyl 2-cyano-3-methylbenzoate
 500024-27-1 95%
1g
 $299 2021-06-17
Chemenu
CM131434-5g
methyl 2-cyano-3-methylbenzoate
 500024-27-1 95%
5g
 $898 2021-06-17
SHANG HAI XIAN DING Biotechnology Co., Ltd.
B-OU968-200mg
Methyl 2-cyano-3-methylbenzoate
 500024-27-1 98+%
200mg
 156.0CNY 2021-07-12
SHANG HAI XIAN DING Biotechnology Co., Ltd.
B-OU968-50mg
Methyl 2-cyano-3-methylbenzoate
 500024-27-1 98+%
50mg
 73.0CNY 2021-07-12
TRC
M341780-10mg
Methyl 2-cyano-3-methylbenzoate
 500024-27-1
10mg
 $ 50.00 2022-06-03
TRC
M341780-50mg
Methyl 2-cyano-3-methylbenzoate
 500024-27-1
50mg
 $ 185.00 2022-06-03
TRC
M341780-100mg
Methyl 2-cyano-3-methylbenzoate
 500024-27-1
100mg
 $ 295.00 2022-06-03

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