AG00336B

26978-65-4 | 2-Bromo-1-ethanesulfonic acid

AG00336B

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CAS Number	26978-65-4
Catalog Number	AG00336B(AGN-PC-07A26K)
Chemical Name	2-Bromo-1-ethanesulfonic acid
EC Number	248-150-8
IUPAC Name	2-bromoethanesulfonic acid
InChI	InChI=1S/C2H5BrO3S/c3-1-2-7(4,5)6/h1-2H2,(H,4,5,6)
InChI Key	OQFSYHWITGFERZ-UHFFFAOYSA-N
MDL Number	MFCD08059352
Molecular Formula	C2H5BrO3S
Molecular Weight	189.0283
SMILES	BrCCS(=O)(=O)O
Synonyms	2-bromoethanesulfonate, 2-bromoethanesulfonic acid, 2-bromoethanesulfonic acid, sodium salt, 2-BROMOETHANESULFONIC ACID, 26978-65-4, 2-Bromo-1-ethanesulfonic acid, 2-Bromoethanesulphonic acid, Ethanesulfonic acid, 2-bromo-, 2-Bromanylethanesulfonic Acid, 2-bromoethane-1-sulfonic acid, C2H5BrO3S, EINECS 248-150-8, 2-BromoethanesulfonicAcid, AC1L1Q1H, SCHEMBL24926, Ethanesulfonic acid,2-bromo-, CTK4F8852, KS-00000EQC, DTXSID30181477, OQFSYHWITGFERZ-UHFFFAOYSA-N, ZINC4261812, MFCD08059352, STL280265, AKOS006284717, MCULE-3291252302, TRA0089301, VZ34573, AJ-49801, AS-31040, SC-96124, SY019880, DB-025851, TR-012166, FT-0611325, ST24040218, Z-4560, MFCD08059352 (95+%), I14-18681, 9SB, 2-Bromo-1-ethanesulfonicacid, C2-H5-Br-O3-S, CID33662, 4-Phenyl-6-(trifluoromethyl)-2-pyrimidinylamine, 179328-22-4,

Complexity	120
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	187.914g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	189.023g/mol
Monoisotopic Mass	187.914g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	62.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H301-H314-H330
Precuationary statements	P260-P280-P284-P301+P310-P305+P351+P338-P310
Siginal words	normal

Certificate of Analysis

Lot Number