Benzo[b]cyclohepta[e][1,4]thiazine-11(5ah)-propanamine,6,7,8,9,10,10a-hexahydro-N,N-dimethyl-2-(trifluoromethyl)-,hydrochloride,hydrate(1:1:2)

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Catalog Number
ACM63917555
Product Name
Benzo[b]cyclohepta[e][1,4]thiazine-11(5ah)-propanamine,6,7,8,9,10,10a-hexahydro-N,N-dimethyl-2-(trifluoromethyl)-,hydrochloride,hydrate(1:1:2)
CAS
63917-55-5
Category
Heterocyclic Organic Compound
Synonyms
CID3048661, CID 3048661, LS-33812, 63917-55-5, Benzo(b)cyclohepta(e)(1,4)thiazine, 5a,6,7,8,9.10,10a,11-octahydro-11-(3-(dimethylamino)propyl)-2-trifluoromethyl-, hydrochloride, dihydrate
IUPAC Name
N,N-dimethyl-3-[2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl]propan-1-amine dihydrate hydrochloride
Molecular Weight
444.9828
Molecular Formula
C19H27F3N2S.ClH.2H₂O
Canonical SMILES
CN(C)CCCN1C2CCCCCC2SC3=C1C=C(C=C3)C(F)(F)F.O.O.Cl
InChI Key
FDSGQKUOFGDRMG-UHFFFAOYSA-N
Boiling Point
441.3ºC at 760mmHg
Flash Point
220.7ºC
Density
g/cm³
Exact Mass
444.18300
H-Bond Acceptor
7
H-Bond Donor
3
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