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Basic Information
CAS No.: 5398-29-8
Name: 3-Isothioureidopropionic acid
Molecular Structure:
Molecular Structure of 5398-29-8 (3-Isothioureidopropionic acid)
Formula: C4H8N2O2S
Molecular Weight: 148.186
Synonyms: Propionicacid, 3-(amidinothio)- (6CI,7CI,8CI);3-(Amidinothio)propionic acid;NSC 4453;b-Isothiureidopropionic acid;
EINECS: 226-430-0
Density: 1.49 g/cm3
Melting Point: 183-184 °C
Boiling Point: 323.4 °C at 760 mmHg
Flash Point: 149.4 °C
Solubility: 12.01g/L at 20℃
Appearance: White powder
PSA: 112.47000
LogP: 0.88780
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  • 3-Isothioureidopropionic acid (ATPN)  CAS No.:5398-29-8

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  • Propanoic acid,3-[(aminoiminomethyl)thio]-

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    5398-29-8

    Propanoic acid,3-[(aminoiminomethyl)thio]-

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Chemistry

Molecular structure of Propanoic acid, 3-((aminoiminomethyl)thio)- (CAS NO.5398-29-8) is:

Product Name: Propanoic acid, 3-((aminoiminomethyl)thio)-
CAS Registry Number: 5398-29-8
IUPAC Name: 3-Carbamimidoylsulfanylpropanoic acid
Molecular Weight: 148.18352 [g/mol]
Molecular Formula: C4H8N2O2S
XLogP3-AA: -0.3
H-Bond Donor: 3
H-Bond Acceptor: 4
EINECS: 226-430-0  
Surface Tension: 66.7 dyne/cm
Density: 1.49 g/cm3
Flash Point: 149.4 °C
Enthalpy of Vaporization: 62.15 kJ/mol
Boiling Point: 323.4 °C at 760 mmHg
Vapour Pressure: 5.37E-05 mmHg at 25 °C

Specification

 Propanoic acid, 3-((aminoiminomethyl)thio)- , its cas register number is 5398-29-8. It also can be called 3-(Amidinothio)propionic acid ; 3-(Aminoiminomethyl)thiopropanoic acid ; beta-Isothiureidopropionic acid .