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5-[3-(Dimethylamino)propyl]-5H-dibenzo[a,d]cycloheptene-3,5-diol

5-[3-(Dimethylamino)propyl]-5H-dibenzo[a,d]cycloheptene-3,5-diol structure

CAS No:
30235-47-3
Formula:
C20H23NO2
Chemical Name:
5-[3-(Dimethylamino)propyl]-5H-dibenzo[a,d]cycloheptene-3,5-diol
Synonyms:
5H-Dibenzo[a,d]cycloheptene-3,5-diol,5-[3-(dimethylamino)propyl]-;5-[3-(Dimethylamino)propyl]-5H-dibenzo[a,d]cycloheptene-3,5-diol

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5-[3-(Dimethylamino)propyl]-5H-dibenzo[a,d]cycloheptene-3,5-diol Basic Attributes

Molecular Weight：

309.4

Exact Mass：

309.40

DSSTox ID：

DTXSID90857803

Characteristics

PSA：

43.70000

XLogP3：

3.45370

Density：

1.166±0.06 g/cm3

Boiling Point：

494.8±45.0 °C(Predicted)

PKA：

9.92±0.40

5-[3-(Dimethylamino)propyl]-5H-dibenzo[a,d]cycloheptene-3,5-diol Use and Manufacturing

An intermediate in the preparation of Cyclobenzaprine metabolite.

Computed Properties

Molecular Weight:309.4
XLogP3:3.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:309.172878976
Monoisotopic Mass:309.172878976
Topological Polar Surface Area:43.7
Heavy Atom Count:23
Complexity:422
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: pyrophosphate formula; stoddard solvent; disodium phosphate; furfuryl alcohol; potassium sulfide formula; molecular formula for nitrate

Guide of 5-[3-(Dimethylamino)propyl]-5H-dibenzo[a,d]cycloheptene-3,5-diol

Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties

5-[3-(Dimethylamino)propyl]-5H-dibenzo[a,d]cycloheptene-3,5-diol

SDS

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