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Basic Information
CAS No.: 17994-94-4
Name: Methyl 7-aminoheptanoate
Article Data: 19
Molecular Structure:
Molecular Structure of 17994-94-4 (Methyl 7-aminoheptanoate)
Formula: C8H17 N O2 . Cl H
Molecular Weight: 195.689
Synonyms: Heptanoicacid, 7-amino-, methyl ester, hydrochloride (8CI,9CI); 7-Aminoheptanoic acidmethyl ester hydrochloride; Methyl 7-aminoheptanoate hydrochloride; Methyl7-aminopentanoate hydrochloride
EINECS: 682-559-6
Density: g/cm3
Melting Point: 119-121℃
Boiling Point: 251.3°Cat760mmHg
Flash Point: 105.8°C
PSA: 52.32000
LogP: 1.76890
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  • Methyl 7-aminoheptanoate hydrochloride

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  • methyl 7-aminoheptanoate

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    methyl 7-aminoheptanoate

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Chemistry

Molecular Structure of Methyl 7-aminoheptanoate (CAS NO.17994-94-4):

Systematic Name: Methyl 7-aminoheptanoate 
Molecular Formula: C8H17NO2
Molecular Weight: 159.23
CAS Registry Number: 17994-94-4 
H bond acceptors: 3
H bond donors: 2
Freely Rotating Bonds: 8
Index of Refraction: 1.442
Molar Refractivity: 44.422 cm3
Molar Volume: 167.749 cm3
Surface Tension: 33.708 dyne/cm
Density: 0.949 g/cm3
Flash Point: 80.734 °C
Enthalpy of Vaporization: 44.77 kJ/mol
Boiling Point: 211.409 °C at 760 mmHg
Vapour Pressure: 0.183 mmHg at 25 °C
SMILES: COC(=O)CCCCCCN
InChI: InChI=1/C8H17NO2/c1-11-8(10)6-4-2-3-5-7-9/h2-7,9H2,1H3 
InChIKey: AZRQWZVPEAHOOA-UHFFFAOYAH

Specification

 Methyl 7-aminoheptanoate (CAS NO.17994-94-4), its Synonyms are Heptanoic acid,7-amino-, methyl ester, hydrochloride (1:1) ; Heptanoicacid, 7-amino-, methyl ester, hydrochloride (8CI,9CI) ; 7-Aminoheptanoic acidmethyl ester hydrochloride ; Methyl 7-aminoheptanoate hydrochloride ; 7-Amino-heptanoic acid methyl ester .