AG003O0X

6996-92-5 | Benzeneseleninic acid

AG003O0X

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CAS Number	6996-92-5
Catalog Number	AG003O0X(AGN-PC-0JKH20)
Chemical Name	Benzeneseleninic acid
EC Number	230-271-2
IUPAC Name	benzeneseleninic acid
InChI	InChI=1S/C6H6O2Se/c7-9(8)6-4-2-1-3-5-6/h1-5H,(H,7,8)
InChI Key	WIHKGDVGLJJAMC-UHFFFAOYSA-N
MDL Number	MFCD00002100
Molecular Formula	C6H6O2Se
Molecular Weight	189.0706
SMILES	O=[Se](C1=CC=CC=C1)O
Synonyms	benzeneseleninic acid, Benzeneseleninic acid, 6996-92-5, benzene selenoic acid, W-104577, Seleninobenzoic acid, BENZENESELENINICACID, C6H6O2Se, phenyl-selensaeure, EINECS 230-271-2, AC1L2MBS, ACMC-1BHR1, BENZENESELENINE ACID, PHENYLSELENINIC ACID, Benzeneseleninic acid, 99%, CHEMBL39469, SCHEMBL1440596, CTK2F3493, DTXSID70220238, WIHKGDVGLJJAMC-UHFFFAOYSA-N, ANW-35804, BDBM50028972, MFCD00002100, AKOS015840364, API0001621, VZ35797, U201, TR-023232, FT-0622645, Benzeneseleninic acid, purum, >=98.0% (T), A836717, I01-19678, InChI=1/C6H6O2Se/c7-9(8)6-4-2-1-3-5-6/h1-5H,(H,7,8, C6-H6-O2-Se, CID23427, B2134, C101202,

Complexity	108
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	189.953g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	189.083g/mol
Monoisotopic Mass	189.953g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301+H331-H373-H410
Packing Group	Ⅲ
Precautionary statements	P261-P273-P301+P310-P311-P501
UN Code	UN 3283

Certificate of Analysis

Lot Number