AG003FJB

59-52-9 | 2,3-Dimercapto-1-propanol

AG003FJB

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CAS Number	59-52-9
Catalog Number	AG003FJB(AGN-PC-0JK6FP)
Chemical Name	2,3-Dimercapto-1-propanol
EC Number	200-433-7
IUPAC Name	2,3-bis(sulfanyl)propan-1-ol
InChI	InChI=1S/C3H8OS2/c4-1-3(6)2-5/h3-6H,1-2H2
InChI Key	WQABCVAJNWAXTE-UHFFFAOYSA-N
MDL Number	MFCD00004864
Molecular Formula	C3H8OS2
Molecular Weight	124.2250
SMILES	OCC(CS)S
UN Number	2810
Synonyms	2,3 Dimercaptopropanol, 2,3 Dithiopropan 1 o1, 2,3-Dimercaptopropanol, 2,3-Dimercaptopropanol, Cadmium, 2,3-Dithiopropan-1-o1, Anti-Lewisite Agent, British, Anti-Lewisite, British, B.A.L., BAL in Oil, British Anti Lewisite, British Anti Lewisite Agent, British Anti-Lewisite, British Anti-Lewisite Agent, Cadmium 2,3 Dimercaptopropanol, Cadmium 2,3-Dimercaptopropanol, Dicaptol, Dimercaprol, in Oil, BAL, Oil, BAL in, DIMERCAPROL, 2,3-Dimercapto-1-propanol, 59-52-9, 2,3-Dimercaptopropanol, Dithioglycerine, Dicaptol, Sulfactin, dimercaptopropanol, 2,3-Dithiopropanol, British Anti-Lewisite, 1,2-Dithioglycerol, Antoxol, Dimersol, Panobal, 1-Propanol, 2,3-dimercapto-, British antilewisite, BAL in Oil, Dimercaprol propanol, Dimercaprolum, Usaf me-1, 1,2-Dimercapto-3-propanol, 2,3-Dimercaptol-1-propanol, 3-Hydroxy-1,2-propanedithiol, BAL, Dimerkaprol, Dithioglycerol, 2,3-Dimercaptopropan-1-ol, alpha,beta-Dithioglycerol, Glycerol, 1,2-dithio-, Sulfactin (VAN), Dimerkaprol [Czech], Dimercaprolo [DCIT], 2,3-Mercaptopropanol, Dithioglycerol (VAN), Dimercaptopropanol (VAN), DMP (VAN), Dimercaprolum [INN-Latin], NSC 4646, 2,3-disulfanylpropan-1-ol, 2,3-Dimercapro, NSC 39515, C3H8OS2, CCRIS 3616, 2,3-bis(sulfanyl)propan-1-ol, CHEBI:64198, HSDB 4004, EINECS 200-433-7, MFCD00004864, 2,3-Mercaptopropan-1-ol, BRN 1732058, Dimercaptol, 1-Propanol, 2,3-dimercapto, .alpha.,.beta.-Dithioglycerol, AI3-61820, NSC4646, WQABCVAJNWAXTE-UHFFFAOYSA-N, Glycerol,2-dithio-, WLN: SH1YSH1Q, 1-Propanol,3-dimercapto-, W-105317, Dimercaprolo, NSC16865, 2,3-Dimercapto-1-propanol, 97.0-100.5%, dithiopropanol, Dimercaprol [INN:BAN:JAN], Anti-Lewisite, Dimercaprol [USP:INN:BAN:JAN], Bal In Oil Injection, Spectrum_001965, ACMC-1AQYA, 2, 3-dimercaptopropanol, 2,3-Mercaptopropanol-1, Spectrum2_001218, Spectrum4_001275, Spectrum5_001622, AC1L1F4N, BAL (TN), CHEMBL1597, DSSTox_CID_20461, DSSTox_RID_79496, DSSTox_GSID_40461, SCHEMBL15969, KBioGR_001890, KBioSS_002524, 2,3 -dimercapto-1-propanol, 4-01-00-02770 (Beilstein Handbook Reference), DivK1c_000997, SPBio_001036, 2,3-Disulfanyl-1-propanol #, Dimercaprol (JP17/USP/INN), DTXSID5040461, CTK3J1382, HMS503G15, KBio1_000997, KBio2_002516, KBio2_005084, KBio2_007652, NINDS_000997, Pharmakon1600-01500252, BCP18145, NSC-4646, NSC39515, Tox21_110014, ANW-33288, BDBM50103608, CCG-39156, NSC-39515, NSC760094, AKOS015895110, DB06782, FCH1115700, NSC-760094, RTR-037211, TRA0055820, CAS-59-52-9, IDI1_000997, NCGC00013216-01, AN-41792, CC-26872, NCI60_001345, SBI-0051351.P002, DB-053404, LS-122148, TR-037211, D0621, FT-0625021, C02924, D00167, AB00051971_02, 004D864, 2,3-Dimercapto-1-propanol, >=98% (iodometric), C-00943, SR-05000001839, I06-0382, SR-05000001839-1, InChI=1/C3H8OS2/c4-1-3(6)2-5/h3-6H,1-2H, dimercaprol-, in Oil, BAL, Oil, BAL in, British Anti Lewisite, Anti-Lewisite, British, 2,3 Dimercaptopropanol, UNII-0CPP32S55X, 2,3 Dithiopropan 1 o1, 2,3-Dithiopropan-1-o1, D0X2IE, British Anti Lewisite Agent, British Anti-Lewisite Agent, Anti-Lewisite Agent, British, Dimercaprol [BAN:INN:JAN], 0CPP32S55X, B.A.L., Cadmium 2,3 Dimercaptopropanol, Cadmium 2,3-Dimercaptopropanol, 2,3-Dimercaptopropanol, Cadmium, CID3080, C3-H8-O-S2, 2,3-Dimercaptopropanol, 97% 1g, NA8027, ZINC00901555, 2,3-Dimercapto-1-propanol, 97% - 1G 1g, DMP, D004112, 1028307-48-3,

Complexity	32
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	124.002g/mol
Formal Charge	0
Heavy Atom Count	6
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	124.216g/mol
Monoisotopic Mass	124.002g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	22.2A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H317-H301-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P280a-P301+P310a-P501a-P264-P270-P280-P301+P310+P330-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P405-P501-P261-P301+P310-P305+P351+P338
UN Code	UN 2810

Certificate of Analysis

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