Compound C38H49NO7S2

3,8-ditert-butylnaphthalene-2,6-disulfonic acid;6-(dimethylamino)-4,4-diphenylhexan-3-one

CAS: 103442-82-6

Molecular Formula	`C38H49NO7S2`
Molecular Weight	695.9 g/mol
Topological Polar Surface Area	146.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	8
Rotatable Bonds	11
Exact Mass	695.29504
Heavy Atoms	48
Complexity	1040.0

Chemical Identifiers

CAS Number	103442-82-6
SMILES	`CCC(=O)C(CCN(C)C)(C1=CC=CC=C1)C2=CC=CC=C2.CC(C)(C)C1=CC2=CC(=CC(=C2C=C1S(=O)(=O)O)C(C)(C)C)S(=O)(=O)O`
InChIKey	`TZCJQCVGPYTLJR-UHFFFAOYSA-N`

📖 Product Overview

Compound C38H49NO7S2 (CAS: 103442-82-6) is a chemical compound with molecular formula C38H49NO7S2 and molecular weight 695.9 g/mol. Its IUPAC systematic name is 3,8-ditert-butylnaphthalene-2,6-disulfonic acid;6-(dimethylamino)-4,4-diphenylhexan-3-one. Topological Polar Surface Area 146.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 8 Rotatable Bonds 11 Exact Mass 695.29504 Heavy Atoms 48 Complexity 1040.0 InChI Key: TZCJQCVGPYTLJR-UHFFFAOYSA-N. SMILES: CCC(=O)C(CCN(C)C)(C1=CC=CC=C1)C2=CC=CC=C2.CC(C)(C)C1=CC2=CC(=CC(=C2C=C1S(=O)(=O)O)C(C)(C)C)S(=O)(=O)O.

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