(R)-4-Benzylthiazolidine-2-thione - CAS 110199-17-2

Name: (R)-4-Benzylthiazolidine-2-thione
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB002606
Product Name:	(R)-4-Benzylthiazolidine-2-thione
CAS:	110199-17-2
Synonyms:	(4R)-4-(phenylmethyl)-2-thiazolidinethione; (4R)-4-benzyl-1,3-thiazolidine-2-thione

Technical Data

IUPAC Name:	(4R)-4-benzyl-1,3-thiazolidine-2-thione
Description:	(R)-4-Benzylthiazolidine-2-thione (CAS# 110199-17-2) is a useful research chemical.
Molecular Weight:	209.33
Molecular Formula:	C10H11NS2
Canonical SMILES:	C1C(NC(=S)S1)CC2=CC=CC=C2
InChI:	InChI=1S/C10H11NS2/c12-10-11-9(7-13-10)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,11,12)/t9-/m1/s1
InChI Key:	SLDUGQISGRPGAW-SECBINFHSA-N
Boiling Point:	328.4 °C at 760 mmHg
Purity:	≥ 97 %
Density:	1.27 g/cm³
Appearance:	White crystalline
Storage:	Room temperature.
MDL:	MFCD06658217
LogP:	2.54780

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2021026273-A1	Scaleable preparation of polyketides	20190806
CA-2950315-A1	Process for the preparation of cyclic depsipeptides	20140527
CN-106456613-A	Process for the preparation of cyclic depsipeptides	20140527
CN-106456613-B	The method for preparing cyclodepsipeptide	20140527
CN-110156874-A	Cyclodepsipeptide compound	20140527

Complexity:	187
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	209.03329170
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	209.03329170
Rotatable Bond Count:	2
Topological Polar Surface Area:	69.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9