DL-3,4-DIHYDROXYPHENYL GLYCOL
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DL-3,4-DIHYDROXYPHENYL GLYCOL
structure -
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CAS No:
28822-73-3
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Formula:
C8H10O4
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Chemical Name:
DL-3,4-DIHYDROXYPHENYL GLYCOL
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Synonyms:
(3,4-DIHYDROXYPHENYL)-GLYCOL;DHPG;DL-B 3,4-TRIHYDROXYPHENETHYLALCOHOL;DL-BETA-3,4-TRIHYDROXY-PHENETHYL ALCOHOL;DL-ALPHA,BETA,3,4-TETRAHYDROXYPHENETHYL ALCOHOL;DL-3,4-DIHYDROXYPHENYL GLYCOL;dl-3-4-dihydroxyphenyl glycol*crystalline;(±)-4-(1,2-dihydroxyethyl)pyrocatechol
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CAS No:
Description
4-(1,2-Dihydroxyethyl)benzene-1,2-diol, a normal norepinephrine metabolite, is found to be associated with Menkes syndrome.
Solid
3,4-dihydroxyphenylethyleneglycol is a tetrol composed of ethyleneglycol having a 3,4-dihydroxyphenyl group at the 1-position. It has a role as a metabolite and a mouse metabolite. It is a member of catechols and a tetrol.
DL-3,4-DIHYDROXYPHENYL GLYCOL Basic Attributes
170.16
170.16
249-260-9
92532
White to Pale Brown
2907299090
Characteristics
80.9
-1.01
1.481±0.06 g/cm3(Predicted)
128-1290C
453.2±40.0 °C(Predicted)
236.6±21.9 °C
1.665
−20°C
9.56±0.10(Predicted)
127.5 Ų [M-H2O-H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|127.7 Ų [M-H-H2O]-
−20°C
Safety Information
3
Xi
26-36
Xi
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
36/37/38
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:170.16
XLogP3:-1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:170.05790880
Monoisotopic Mass:170.05790880
Topological Polar Surface Area:80.9
Heavy Atom Count:12
Complexity:139
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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