AG00BL3Q

3111-52-2 | BENZENETHIOL, POTASSIUM SALT

AG00BL3Q

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CAS Number	3111-52-2
Catalog Number	AG00BL3Q(AGN-PC-0R6FOT)
Chemical Name	BENZENETHIOL, POTASSIUM SALT
IUPAC Name	potassium;benzenethiolate
InChI	InChI=1S/C6H6S.K/c7-6-4-2-1-3-5-6;/h1-5,7H;/q;+1/p-1
InChI Key	OALPPYUMFWGHEK-UHFFFAOYSA-M
MDL Number	MFCD20483758
Molecular Formula	C6H5KS
Molecular Weight	148.2672
SMILES	[S-]C1=CC=CC=C1.[K+]
Synonyms	Potassium Benzenethiolate, 3111-52-2, potassium thiophenolate, potassium thiophenoxide, SCHEMBL1260888, KS-00000SNO, OALPPYUMFWGHEK-UHFFFAOYSA-M, MFCD20483758, AKOS027323963, AK316593, BENZENETHIOL, POTASSIUM SALT, CID11171061, CID11789364,

Complexity	50.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	147.975g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	148.264g/mol
Monoisotopic Mass	147.975g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H332-H335
Precuationary statements	P280-P305+P351+P338-P310
Siginal words

Certificate of Analysis

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