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Hydroxychavicol

Hydroxychavicol structure

CAS No:
1126-61-0
Formula:
C9H10O2
Chemical Name:
Hydroxychavicol
Synonyms:
1,2-Benzenediol,4-(2-propen-1-yl)-;Pyrocatechol,4-allyl-;1,2-Benzenediol,4-(2-propenyl)-;4-(2-Propen-1-yl)-1,2-benzenediol;4-Allylcatechol;1,2-Dihydroxy-4-allylbenzene;4-Allyl-1,2-dihydroxybenzene;1-Allyl-3,4-dihydroxybenzene;4-Allylpyrocatechol;4-(2′-Propenyl)-1,2-benzenediol;Hydroxychavicol;4-(2-Propenyl)-1,2-benzenediol;Desmethyleugenol;4-Allyl-1,2-Benzenediol;3,4-Dihydroxyallylbenzene;p-Allylcatechol
Categories:
Natural Products > Phenylpropanoids

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Description

4-Allylcatechol (4-Allylpyrocatechol, Hydroxychavicol) is an intermediate to synthetic safrole.

Hydroxychavicol Basic Attributes

Molecular Weight：

150.177

Exact Mass：

150.17

DSSTox ID：

DTXSID20150112

HScode：

2907299090

Characteristics

PSA：

40.5

XLogP3：

1.90

Density：

1.148±0.06 g/cm3(Predicted)

Melting Point：

48 °C

Boiling Point：

147-149 °C @ Press: 10 Torr

Flash Point：

141℃

Refractive Index：

1.587

Water Solubility：

0.17 M

Storage Conditions：

2-8°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

RTECS Number：

CZ9029440

Precautionary statement(s)：

P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

Metabolism/Metabolites：

Hydroxychavicol is a known human metabolite of eugenol.

MeSH Entry Terms：

2-hydroxychavicol

Computed Properties

Molecular Weight:150.17
XLogP3:0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:150.068079557
Monoisotopic Mass:150.068079557
Topological Polar Surface Area:40.5
Heavy Atom Count:11
Complexity:134
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of Hydroxychavicol

HANGZHOU LEAP CHEM CO., LTD. Contact Supplier

CN
5 YRS

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Trader Supplier of Intermediates,Building blocks,API,Silicones,Peptides,Lab chemicals,Biochemicals,Pharmaceuticals,Screening Compounds,Food Additives

2-hydroxy chavicol

CAS No.: 1126-61-0

Content: 99.00%

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Hangzhou KieRay Chem Co.,LTD Contact Supplier

CN
5 YRS

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Manufactory Supplier of fine chemicals,pharmaceutical materials

3,4-DIHYDROXY-ALLYLBENZENE

CAS No.: 1126-61-0

Grade: industrial Grade

Content: 98%

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Guide of Hydroxychavicol

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
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Hydroxychavicol

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