AG005Q5F

Name: 2(3H)-Benzothiazolone,3-(hydroxymethyl)-
Brand: Angene Chemical
SKU: AG005Q5F

72679-97-1 | 2(3H)-Benzothiazolone,3-(hydroxymethyl)-

AG005Q5F

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CAS Number	72679-97-1
Catalog Number	AG005Q5F(AGN-PC-0KK673)
Chemical Name	2(3H)-Benzothiazolone,3-(hydroxymethyl)-
IUPAC Name	3-(hydroxymethyl)-1,3-benzothiazol-2-one
InChI	InChI=1S/C8H7NO2S/c10-5-9-6-3-1-2-4-7(6)12-8(9)11/h1-4,10H,5H2
InChI Key	QGEJJONTBKAEKC-UHFFFAOYSA-N
MDL Number	MFCD02670991
Molecular Formula	C8H7NO2S
Molecular Weight	181.2117
SMILES	O=C1SC2=CC=CC=C2N1CO
Synonyms	72679-97-1, 3-(HYDROXYMETHYL)-2-BENZOTHIAZOLINONE, 2(3H)-Benzothiazolone,3-(hydroxymethyl)-, 3-(Hydroxymethyl)benzo[d]thiazol-2(3H)-one, 3-HYDROXYMETHYL-2-BENZOTHIAZOLINONE, 3-(hydroxymethyl)-3-hydrobenzothiazol-2-one, AC1MBZLR, SCHEMBL10831761, CTK5D6649, DTXSID50369997, QGEJJONTBKAEKC-UHFFFAOYSA-N, ZINC405675, MFCD01074863, SBB056345, AKOS025116917, AS-40045, ZB013635, 3-(hydroxymethyl)-1,3-benzothiazol-2-one, FT-0615847, ST50825166, 3-(Hydroxymethyl)-1,3-benzothiazol-2(3H)-one, 3- -2-BENZOTHIAZOLINONE, ZINC00405675, CID2733751,

Complexity	198
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.02g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	181.209g/mol
Monoisotopic Mass	181.02g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	65.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited