Cas no 22426-27-3 (2-cyano-3-methylbutanoic acid)

2-cyano-3-methylbutanoic acid structure
2-cyano-3-methylbutanoic acid structure
Product Name:2-cyano-3-methylbutanoic acid
CAS No:22426-27-3
MF:C6H9NO2
MW:127.141161680222
CID:290408
PubChem ID:255338
Update Time:2025-09-23

2-cyano-3-methylbutanoic acid Chemical and Physical Properties

Names and Identifiers

    • Butanoic acid,2-cyano-3-methyl-
    • 2-cyano-3-methylbutanoic acid
    • (+-)-2-Cyan-3-methyl-buttersaeure
    • 2-Cyan-3-methyl-buttersaeure
    • 2-cyano-3-methyl-butyric acid
    • 2-Cyano-3-methylbutyric acid
    • AC1L5S6N
    • AC1Q4QIP
    • AR-1E0834
    • CCG-40380
    • CTK4E9465
    • dl-Isopropylmalonsaeure-mononitril
    • Isopropylcyanessigsaeure
    • NSC80743
    • HAGRVRKSGQTFKQ-UHFFFAOYSA-N
    • SCHEMBL658967
    • DTXSID30292193
    • EN300-144930
    • MFCD12022610
    • CS-0234640
    • cyanoisovaleric acid
    • starbld0019582
    • 22426-27-3
    • NSC-80743
    • AKOS012576354
    • Inchi： 1S/C6H9NO2/c1-4(2)5(3-7)6(8)9/h4-5H,1-2H3,(H,8,9)
    • InChI Key： HAGRVRKSGQTFKQ-UHFFFAOYSA-N
    • SMILES： OC(C(C#N)C(C)C)=O

Computed Properties

  • Exact Mass: 127.06337
  • Monoisotopic Mass: 127.063328530g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 2
  • Complexity: 154
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1
  • Topological Polar Surface Area: 61.1?2

Experimental Properties

  • PSA: 61.09

2-cyano-3-methylbutanoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-144930-50mg
2-cyano-3-methylbutanoic acid
 22426-27-3 95.0%
50mg
 $168.0 2023-09-29
Enamine
EN300-144930-100mg
2-cyano-3-methylbutanoic acid
 22426-27-3 95.0%
100mg
 $252.0 2023-09-29
Enamine
EN300-144930-250mg
2-cyano-3-methylbutanoic acid
 22426-27-3 95.0%
250mg
 $361.0 2023-09-29
Enamine
EN300-144930-500mg
2-cyano-3-methylbutanoic acid
 22426-27-3 95.0%
500mg
 $569.0 2023-09-29
Enamine
EN300-144930-1000mg
2-cyano-3-methylbutanoic acid
 22426-27-3 95.0%
1000mg
 $728.0 2023-09-29
Enamine
EN300-144930-2500mg
2-cyano-3-methylbutanoic acid
 22426-27-3 95.0%
2500mg
 $1428.0 2023-09-29
Enamine
EN300-144930-5000mg
2-cyano-3-methylbutanoic acid
 22426-27-3 95.0%
5000mg
 $2110.0 2023-09-29
Enamine
EN300-144930-10000mg
2-cyano-3-methylbutanoic acid
 22426-27-3 95.0%
10000mg
 $3131.0 2023-09-29
Enamine
EN300-144930-0.05g
2-cyano-3-methylbutanoic acid
 22426-27-3 95%
0.05g
 $168.0 2023-02-15
Enamine
EN300-144930-0.1g
2-cyano-3-methylbutanoic acid
 22426-27-3 95%
0.1g
 $252.0 2023-02-15

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