Compound C9H11F3S

2,2,3-trifluoro-7a-methyl-4,5,6,7-tetrahydro-1-benzothiophene

CAS: 100333-45-7

Molecular Formula	`C9H11F3S`
Molecular Weight	208.25 g/mol
LogP	2.7
Topological Polar Surface Area	25.3 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	0
Exact Mass	208.05336
Heavy Atoms	13
Complexity	272.0

Chemical Identifiers

CAS Number	100333-45-7
SMILES	`CC12CCCCC1=C(C(S2)(F)F)F`
InChIKey	`XUQQKAFRTLETGP-UHFFFAOYSA-N`

📖 Product Overview

Compound C9H11F3S (CAS: 100333-45-7) is a chemical compound with molecular formula C9H11F3S and molecular weight 208.25 g/mol. Its IUPAC systematic name is 2,2,3-trifluoro-7a-methyl-4,5,6,7-tetrahydro-1-benzothiophene. LogP 2.7 Topological Polar Surface Area 25.3 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 0 Exact Mass 208.05336 Heavy Atoms 13 Complexity 272.0 InChI Key: XUQQKAFRTLETGP-UHFFFAOYSA-N. SMILES: CC12CCCCC1=C(C(S2)(F)F)F.

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