AG003BJT

94594-90-8 | (3aS,6R,7aR)-8,8-Dimethylhexahydro-1H-3a,6-methanobenzo[c]isothiazole 2,2-dioxide

AG003BJT

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CAS Number	94594-90-8
Catalog Number	AG003BJT(AGN-PC-0W46OD)
Chemical Name	(3aS,6R,7aR)-8,8-Dimethylhexahydro-1H-3a,6-methanobenzo[c]isothiazole 2,2-dioxide
IUPAC Name	(1S,5R,7R)-10,10-dimethyl-3λ6-thia-4-azatricyclo[5.2.1.01,5]decane 3,3-dioxide
InChI	InChI=1S/C10H17NO2S/c1-9(2)7-3-4-10(9)6-14(12,13)11-8(10)5-7/h7-8,11H,3-6H2,1-2H3/t7-,8-,10-/m1/s1
InChI Key	DPJYJNYYDJOJNO-NQMVMOMDSA-N
MDL Number	MFCD00066271
Molecular Formula	C10H17NO2S
Molecular Weight	215.3125
SMILES	CC1([C@]23[C@@](NS(=O)(C3)=O)([H])C[C@@]1([H])CC2)C
Synonyms	94594-90-8, (2R)-Bornane-10,2-sultam, (1S)-(-)-2,10-Camphorsultam, (-)-10,2-Camphorsultam, MFCD00066271, (3aS,6S,7aS)-8,8-Dimethylhexahydro-1H-3a,6-methanobenzo[c]isothiazole 2,2-dioxide, AK-47429, PubChem8144, AC1LGYRO, (-)-2,10-camphorsultam, (R)-Bornane-10,2-sultam, SCHEMBL2831086, (-)-exo-10,2-Bornanesultam, KS-00000EVJ, (1S,5R)-10,10-Dimethyl-3-thia-4-azatricyclo[5.2.1.01,5]decane 3,3-dioxide, (1S,5R,7R)-10,10-dimethyl-3$l^{6}-thia-4-azatricyclo[5.2.1.0^{1,5}]decane-3,3-dione, DPJYJNYYDJOJNO-NQMVMOMDSA-N, ZINC402802, EBD14772, (1S,2R,4R)-2,10-camphorsultam, AKOS005146010, 3H-3a,6-Methano-2,1-benzisothiazole, hexahydro-8,8-dimethyl-, 2,2-dioxide, (3aS,6R,7aR)-, BP-12255, ZB012956, (1S)-(-)-2,10-Camphorsultam, 98%, AM20120717, 594B908, (1S,4alpha)-2alpha-Aminobornane-10-sulfonic acid sultam, (1S,5R,7R)-10,10-dimethyl-3-lambda6-thia-4-azatricyclo[5.2.1.01,5]decane 3,3-dioxide;, [3aS-(3a|A,6|A,7a|A)]-hexahydro-8,8-dimethyl-3H-3a,6-methano-2,1-benzisothiazole-2,2-dioxide, -Bornane-10,2-sultam, (-)-L-2,10-Camphorsultam, ACN-S001987, CID854020, ZINC00404778, (1S,2R)-(-)-10,2-Camphorsultam, (1S)-(-)-2,10-Camphorsultam, 99% 1g, (2R)-Bornane-10,2-sultam, 98% - 1G 1g,

Complexity	381
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Exact Mass	215.098g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	215.311g/mol
Monoisotopic Mass	215.098g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	54.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number