AG003M2Z

940-69-2 | Dl-5-(1,2-dithiolan-3-yl)valeramide

AG003M2Z

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CAS Number	940-69-2
Catalog Number	AG003M2Z(AGN-PC-0JK5OS)
Chemical Name	Dl-5-(1,2-dithiolan-3-yl)valeramide
IUPAC Name	5-(dithiolan-3-yl)pentanamide
InChI	InChI=1S/C8H15NOS2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H2,9,10)
InChI Key	FCCDDURTIIUXBY-UHFFFAOYSA-N
MDL Number	MFCD00005475
Molecular Formula	C8H15NOS2
Molecular Weight	205.3408
SMILES	O=C(N)CCCCC1SSCC1
Synonyms	1,2-dithiolane-3-valeramide, 6,8-thioctic amide, alpha-lipoic amide, lipamide, lipoamide, lipoamide, (+-)-isomer, lipoamide, Thioctamide, thioctic acid amide, 940-69-2, Vitamin N, 5-(1,2-Dithiolan-3-yl)pentanamide, alpha-Lipoic acid amide, dl-6,8-Thioctamide, Lipamide, Lipoacin, Lipoamid, Lipozyme, 3206-73-3, Thioctamid, Lipoicin, Lypoaran, Pathoclon, Thioami, Thiotomin, Ticolin, DL-lipoamide, 1,2-Dithiolane-3-pentanamide, dl-alpha-Lipoamide, (+/-)-alpha-Lipoamide, 5-(dithiolan-3-yl)pentanamide, alpha-Lipoamide, DL-5-(1,2-Dithiolan-3-yl)valeramide, 5-(1,2-Dithiolan-3-yl)valeramide, alpha-Lipoic amide, dl-6-Thioctic amide, Lipoamide, alpha-, 1,2-DITHIOLANE-3-VALERAMIDE, DL-6,8-Thioctic acid amide, 5-(Dithiolan-3-yl)valeramide, EINECS 213-375-2, Thioctic acid amide (JAN), BRN 0122470, DL-6,8-Epidithiooctanamide, CHEBI:17460, FCCDDURTIIUXBY-UHFFFAOYSA-N, NSC90787, NCGC00166104-01, 1,2-Dithiolane-3-pentanamide, (.+/-.)-, DSSTox_CID_26541, DSSTox_RID_81705, DSSTox_GSID_46541, thioctic amide, CAS-940-69-2, 5-(1,2)Dithiolan-3-yl-pentanoic acid amide, 5-[1,2]Dithiolan-3-yl-pentanoic acid amide, dl-alpha-lipoic acid amide, (+-)-Thioctic acid amide, dl-thioctamide, alpha-Lipamide, Alpha-lipoate, a-Lipoamide, 5-(1,2-dithiolan-3-yl)-pentanamide, D,L-Lipoamide, DL -Lipoamide, .alpha.-Lipamide, 6-Thioctic amide, (S)-Lipoamide, .alpha.-Lipoamide, DL-|A-Lipoamide, (+-)-1,2-Dithiolane-3-valeramide, NSC 90787, (+-)-1,2-Dithiolane-3-pentanamide, Tioctan (Salt/Mix), dl-thioctic acid amide, 6-Thioctic acid amide, (??)- a-Lipoamide, Maybridge4_001874, dl-lipoamide oxidized form, .alpha.-Lipoic acid amide, bmse000769, AC1Q5J8V, NCIOpen2_006211, SCHEMBL50599, 5-19-07-00238 (Beilstein Handbook Reference), AC1L1A72, 1,2-Dithiolane-3-pentanamide-, 1,2-Dithiolane-3-valeroylamide, CHEMBL1403899, DTXSID2046541, BDBM16435, CTK3I6738, FCCDDURTIIUXBY-UHFFFAOYSA-, HMS1526F04, HMS3264F08, Pharmakon1600-01505740, HY-B1142, KS-000017PJ, Tox21_112317, 6043AC, CCG-42144, CL-008, LMFA08010006, MFCD00005475, NSC-90787, NSC759236, AKOS015897492, Tox21_112317_1, AC-8132, AN-8307, CS-4705, MCULE-3905195412, NSC-759236, VC30858, 5-(1,2-Dithiolan-3-yl)pentanamide #, NCGC00166104-02, NCGC00166104-04, AN-48112, dl-6,8-thioctic acid amide oxidized form, LS-63313, M957, SC-51119, SBI-0207048.P001, ( inverted exclamation markA)-|A-Lipoamide, TL8002438, (+/-)-alpha-Lipoamide, analytical standard, FT-0625517, ST24029256, ST50989902, C00248, D00048, AB01563370_01, 206T733, SR-01000632164, I09-1099, SR-01000632164-1, SR-01000632164-2, W-100216, BRD-A14440173-001-01-8, I14-45348, 4BFBE47A-76FD-447C-883B-E049423E6511, InChI=1/C8H15NOS2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H2,9,10), |A-Lipoic amide, alpha-Lipoic acid, (R)-lipoamide, DL-5- valeramide, 6,8-thioctic amide, lipoamide, (+-)-isomer, C8H15NOS2, UNII-Q1GT04827L, CID863, Q1GT04827L, C8-H15-N-O-S2, ACN-S005459, EINECS 221-710-9, AR-1I6807, A5770, T0818, C013091, 996-70-3,

Complexity	152
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.06g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	205.334g/mol
Monoisotopic Mass	205.06g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	93.7A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P264-P270-P301+P312+P330-P501
UN Code

Certificate of Analysis

Lot Number