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1-(beta-Dimethylaminoaethyl)-2-ethoxycarbonyl-3-ethoxy-6-chlor-indol-t oluol-4-sulfonat

1-(beta-Dimethylaminoaethyl)-2-ethoxycarbonyl-3-ethoxy-6-chlor-indol-t oluol-4-sulfonat structure

CAS No:
77941-23-2
Formula:
C17H23ClN2O3.C7H8O3S
Chemical Name:
1-(beta-Dimethylaminoaethyl)-2-ethoxycarbonyl-3-ethoxy-6-chlor-indol-t oluol-4-sulfonat
Synonyms:
1-(beta-Dimethylaminoaethyl)-2-ethoxycarbonyl-3-ethoxy-6-chlor-indol-toluol-4-sulfonat;1H-Indole-2-carboxylic acid, 6-chloro-1-(2-(dimethylamino)ethyl)-3-ethoxy-, ethyl ester, 4-methylbenzenesulfonate;SCHEMBL11207667;CTK2I0138;DTXSID40228600;LS-82557;ethyl 6-chloro-1-(2-dimethylaminoethyl)-3-ethoxy-indole-2-carboxylate; 4-methylbenzenesulfonic acid

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1-(beta-Dimethylaminoaethyl)-2-ethoxycarbonyl-3-ethoxy-6-chlor-indol-t oluol-4-sulfonat Basic Attributes

Molecular Weight：

511.036

Exact Mass：

510.159

DSSTox ID：

DTXSID40228600

Characteristics

PSA：

106

XLogP3：

5.75420

Boiling Point：

462.6ºC at 760 mmHg

Flash Point：

233.6ºC

Computed Properties

Molecular Weight:511.0
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:510.1591356
Monoisotopic Mass:510.1591356
Topological Polar Surface Area:106
Heavy Atom Count:34
Complexity:600
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 1-(beta-Dimethylaminoaethyl)-2-ethoxycarbonyl-3-ethoxy-6-chlor-indol-t oluol-4-sulfonat

Basic Attributes
Characteristics
Computed Properties

1-(beta-Dimethylaminoaethyl)-2-ethoxycarbonyl-3-ethoxy-6-chlor-indol-t oluol-4-sulfonat

SDS

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