EPTC - CAS 759-94-4

Catalog:	BB066195
Product Name:	EPTC
CAS:	759-94-4
Synonyms:	S-Ethyl-N,N-dipropylthiocarbamate

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	S-ethyl N,N-dipropylcarbamothioate
Description:	EPTC is a pesticide, S-Ethyl-N,N-dipropylthiocarbamate.
Molecular Weight:	189.32
Molecular Formula:	C9H19NOS
Canonical SMILES:	CCCN(CCC)C(=O)SCC
InChI:	InChI=1S/C9H19NOS/c1-4-7-10(8-5-2)9(11)12-6-3/h4-8H2,1-3H3
InChI Key:	GUVLYNGULCJVDO-UHFFFAOYSA-N
Boiling Point:	261 °F at 20 mmHg
Flash Point:	116 °C
Density:	0.955
Solubility:	Chloroform (Slightly), Methanol (Slightly)
Appearance:	Colourless Oil
Storage:	-20°C, Hygroscopic
References:	Diyanat, M., & Ghasemkhan-Ghajar, F. Int. J. Adv. Biol., 8, 290 (2020).
Refractive Index:	1.4750 at 30 °C/D
Stability:	Stable under storage conditions

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GHS Hazard Statement:	H302: Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P317, P330, and P501
Signal Word:	Warning

Complexity:	122
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	189.1187354
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	189.1187354
Rotatable Bond Count:	6
Topological Polar Surface Area:	45.6Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2