 Home > Encyclopedia > 3H-Indolium, 1-ethyl-2-[3-(1-ethyl-1,3-dihydro-3,3-dimethyl-2H-indol-2-ylidene)-1-propen-1-yl]-3,3-dimethyl-, 4-methylbenzenesulfonate (1:1)

3H-Indolium, 1-ethyl-2-[3-(1-ethyl-1,3-dihydro-3,3-dimethyl-2H-indol-2-ylidene)-1-propen-1-yl]-3,3-dimethyl-, 4-methylbenzenesulfonate (1:1)

3H-Indolium, 1-ethyl-2-[3-(1-ethyl-1,3-dihydro-3,3-dimethyl-2H-indol-2-ylidene)-1-propen-1-yl]-3,3-dimethyl-, 4-methylbenzenesulfonate (1:1) structure

CAS No:
65294-07-7
Formula:
C27H33N2.C7H7O3S
Chemical Name:
3H-Indolium, 1-ethyl-2-[3-(1-ethyl-1,3-dihydro-3,3-dimethyl-2H-indol-2-ylidene)-1-propen-1-yl]-3,3-dimethyl-, 4-methylbenzenesulfonate (1:1)
Synonyms:
3H-Indolium,1-ethyl-2-[3-(1-ethyl-1,3-dihydro-3,3-dimethyl-2H-indol-2-ylidene)-1-propen-1-yl]-3,3-dimethyl-,4-methylbenzenesulfonate (1:1);3H-Indolium,1-ethyl-2-[3-(1-ethyl-1,3-dihydro-3,3-dimethyl-2H-indol-2-ylidene)-1-propenyl]-3,3-dimethyl-,salt with 4-methylbenzenesulfonic acid (1:1)

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3H-Indolium, 1-ethyl-2-[3-(1-ethyl-1,3-dihydro-3,3-dimethyl-2H-indol-2-ylidene)-1-propen-1-yl]-3,3-dimethyl-, 4-methylbenzenesulfonate (1:1) Basic Attributes

Molecular Weight：

556.8 g/mol

Exact Mass：

556.27596432 g/mol

DSSTox ID：

DTXSID9070298

Characteristics

PSA：

71.8 Å²

3H-Indolium, 1-ethyl-2-[3-(1-ethyl-1,3-dihydro-3,3-dimethyl-2H-indol-2-ylidene)-1-propen-1-yl]-3,3-dimethyl-, 4-methylbenzenesulfonate (1:1) Use and Manufacturing

Manufacturing Info：

3H-Indolium, 1-ethyl-2-[3-(1-ethyl-1,3-dihydro-3,3-dimethyl-2H-indol-2-ylidene)-1-propen-1-yl]-3,3-dimethyl-, 4-methylbenzenesulfonate (1:1): ACTIVE

Computed Properties

Molecular Weight:556.8
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:556.27596432
Monoisotopic Mass:556.27596432
Topological Polar Surface Area:71.8
Heavy Atom Count:40
Complexity:843
Undefined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 3H-Indolium, 1-ethyl-2-[3-(1-ethyl-1,3-dihydro-3,3-dimethyl-2H-indol-2-ylidene)-1-propen-1-yl]-3,3-dimethyl-, 4-methylbenzenesulfonate (1:1)

Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties

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