gamma-Guanidino-beta-hydroxybutyric acid

Base Information

• Chemical Name: gamma-Guanidino-beta-hydroxybutyric acid
• CAS No.: 7010-89-1
• Molecular Formula: C5H11N3O3
• Molecular Weight: 161.1591
• NSC Number: 291290
• UNII: 94G2CXKMT3
• DSSTox Substance ID: DTXSID701227985
• Nikkaji Number: J2.366.475E
• Mol file: 7010-89-1.mol

Synonyms:7010-89-1;NSC291290;94G2CXKMT3;NSC-291290;4-Guanidino-3-hydroxybutanoic acid, (+/-)-;4-[(Aminoiminomethyl)amino]-3-hydroxybutanoic acid;Butanoic acid, 4-((aminoiminomethyl)amino)-3-hydroxy-;Butanoic acid, 4-[(aminoiminomethyl)amino]-3-hydroxy-;gamma-Guanidino-beta-hydroxybutyric acid;4-((AMINOIMINOMETHYL)AMINO)-3-HYDROXYBUTANOIC ACID;GUANIDINO-B-HYDROXYBUTYRIC ACID, Y-;UNII-94G2CXKMT3;SCHEMBL10079592;3-hydroxy-4-guanidinobutyric acid;DTXSID701227985;4-Guanidino-3-hydroxybutanoic acid;NSC 291290;4-GUANIDINO-3-HYDROXY-, BUTYRIC ACID;DL-4-GUANIDINO-3-HYDROXYBUTANOIC ACID;.BETA.-HYDROXY-.GAMMA.-GUANIDINOBUTYRIC ACID;.GAMMA.-GUANIDINO-.BETA.-HYDROXYBUTYRIC ACID;4-((AMINOIMINOMETHYL)AMINO)-3-HYDROXY-, BUTANOIC ACID

Chemical Property of gamma-Guanidino-beta-hydroxybutyric acid

Chemical Property:

• Vapor Pressure: 2.42E-09mmHg at 25°C
• Boiling Point: 433.7°Cat760mmHg
• Flash Point: 216.1°C
• Density: 1.56g/cm³
• XLogP3: -2.4
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 161.08004122
• Heavy Atom Count: 11
• Complexity: 164

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(CN=C(N)N)O)C(=O)O

Technology Process of gamma-Guanidino-beta-hydroxybutyric acid

There total 4 articles about gamma-Guanidino-beta-hydroxybutyric acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

mildiomycin (67527-71-3) → 3-Hydroxy-4-guanidino-buttersaeure (7010-89-1)

Guidance literature:

With hydrogenchloride; periodic acid; for 2h; Heating;

DOI:10.1016/S0040-4020(01)92447-0

Reference yield:

DL-4-amino-3-hydroxybutyric acid (924-49-2,352-21-6) + CYANAMID (420-04-2) → 3-Hydroxy-4-guanidino-buttersaeure (7010-89-1)

Guidance literature:

With ammonium hydroxide;

Reference yield:

L-erythro-2-amino-5-guanidino-4-hydroxy-valeric acid (98443-22-2) → (R)-4-guanidino-3-hydroxy-butyric acid (7010-89-1,62594-35-8,87727-00-2)

Guidance literature:

Herstellung durch oxidative Desaminierung und Decarboxylierung;

DOI:10.1246/bcsj.32.349

upstream raw materials:

L-erythro-2-amino-5-guanidino-4-hydroxy-valeric acid

DL-4-amino-3-hydroxybutyric acid

CYANAMID

mildiomycin

Refernces