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cis-5,6,7,8-tetrahydronaphthalene-1,6,7-triol

cis-5,6,7,8-tetrahydronaphthalene-1,6,7-triol structure

CAS No:
35697-16-6
Formula:
C10H12O3
Chemical Name:
cis-5,6,7,8-tetrahydronaphthalene-1,6,7-triol
Synonyms:
cis-5,6,7,8-tetrahydronaphthalene-1,6,7-triol;cis-5,6,7,8-Tetrahydro-1,6,7-naphthalenetriol;cis-5,6,7,8-Tetrahydrogen-6,7-Dihydroxy-1-Naphthol;(6S,7R)-5,6,7,8-tetrahydronaphthalene-1,6,7-triol;1,6,7-Naphthalenetriol, 5,6,7,8-tetrahydro-, (6R,7S)-rel-

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cis-5,6,7,8-tetrahydronaphthalene-1,6,7-triol Basic Attributes

Molecular Weight：

180.2

Exact Mass：

180.20

EC Number：

252-682-6

Characteristics

PSA：

60.69000

XLogP3：

0.21260

Density：

1.400±0.06 g/cm3(Predicted)

Melting Point：

188-188.5 °C(Solv: ethanol (64-17-5))

Boiling Point：

363.8±42.0 °C(Predicted)

Flash Point：

183.4ºC

Refractive Index：

1.67

PKA：

10.29±0.60(Predicted)

cis-5,6,7,8-tetrahydronaphthalene-1,6,7-triol Use and Manufacturing

cis-5,6,7,8-Tetrahydro-1,6,7-naphthalenetriol is an intermediate used to prepare nondepressant β-adrenergic blocking agents.

Computed Properties

Molecular Weight:180.20
XLogP3:0.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Exact Mass:180.078644241
Monoisotopic Mass:180.078644241
Topological Polar Surface Area:60.7
Heavy Atom Count:13
Complexity:183
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of cis-5,6,7,8-tetrahydronaphthalene-1,6,7-triol

Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties

cis-5,6,7,8-tetrahydronaphthalene-1,6,7-triol

SDS

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