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Name	Desmethyldoxepin	EINECS	N/A
CAS No.	5626-16-4	Density	1.184g/cm³
PSA	35.25000	LogP	4.05980
Solubility	N/A	Melting Point	N/A
Formula	C₁₇H₁₇NO	Boiling Point	418.6°C at 760 mmHg
Molecular Weight	251.35	Flash Point	213.8°C
Transport Information	N/A	Appearance	N/A
Safety	Poison by ingestion, intravenous, and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NO_x. See also DOXEPIN.	Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	Didemethyldoxepin;KS 1675;

Desmethyldoxepin Chemical Properties

IUPAC Name: (3Z)-3-(6H-Benzo[c][1]benzoxepin-11-ylidene)propan-1-amine
Molecular Formula: C₁₇H₁₇NO
Molecular Weight: 251.35
Freely Rotating Bonds: 3
Polar Surface Area: 12.47 Å²
Index of Refraction: 1.667
Molar Refractivity: 79.06 cm³
Molar Volume: 212.2 cm³
Polarizability: 31.34 ×10^-24cm³
Surface Tension: 55.2 dyne/cm
Density: 1.184 g/cm³
Flash Point: 213.8 °C
Enthalpy of Vaporization: 67.22 kJ/mol
Boiling Point: 418.6 °C at 760 mmHg
Vapour Pressure: 3.23E-07 mmHg at 25°C
The Cas Register Number of Desmethyldoxepin is 5626-16-4.The chemical synonyms of Desmethyldoxepin (CAS NO.5626-16-4) are 1-Propanamine, 3-dibenz(b,e)oxepin-11(6H)-ylidene- (9CI) ; 3-[Dibenz[b,e]oxepin-11(6H)-ylidene]-1-propanamine .The molecular structure of Desmethyldoxepin (CAS NO.5626-16-4) is.

Desmethyldoxepin Uses

Desmethyldoxepin (CAS NO.5626-16-4) is used in organic synthesis.

Desmethyldoxepin Toxicity Data With Reference

1.	ipr-rat LD50:100 mg/kg	ARZNAD Arzneimittel-Forschung. Drug Research. 15 (1965),863.
2.	orl-mus LD50:118 mg/kg	ARZNAD Arzneimittel-Forschung. Drug Research. 15 (1965),863.
3.	ipr-mus LD50:92 mg/kg	ARZNAD Arzneimittel-Forschung. Drug Research. 15 (1965),863.
4.	ivn-mus LD50:29 mg/kg	ARZNAD Arzneimittel-Forschung. Drug Research. 15 (1965),863.
5.	ivn-rbt LD50:13,400 µg/kg	ARZNAD Arzneimittel-Forschung. Drug Research. 15 (1965),863.

Desmethyldoxepin Safety Profile

Poison by ingestion, intravenous, and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NO_x. See also DOXEPIN.

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