DL-ALPHA-(METHYLAMINOMETHYL)BENZYL ALCOHOL
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DL-ALPHA-(METHYLAMINOMETHYL)BENZYL ALCOHOL
structure -
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CAS No:
6589-55-5
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Formula:
C9H13NO
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Chemical Name:
DL-ALPHA-(METHYLAMINOMETHYL)BENZYL ALCOHOL
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Synonyms:
DL-^a-(Methylaminomethyl)benzyl alcohol, 99%;2-(Methylamino)-1-phenylethanol alpha-(Methylaminomethyl)benzyl alcohol;2-METHYLAMINO-1-PHENYLETHANOL;Halostachine~2-(Methylamino)-1-phenylethanol;2-(methylamino)-1-phenyl-ethano;alpha-((methylamino)methyl)-benzylalcoho;alpha-(methylamino)benzylalcohol;win5529-2
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CAS No:
Description
white crystals
Solid
N-methylphenylethanolamine is an alkaloid that is ethanolamine having the phenyl group at the 1-position and a methyl group attached to the nitrogen. It has been isolated from Halostachys caspica. It has a role as a human metabolite and a plant metabolite. It is an alkaloid and a member of phenylethanolamines. It is a conjugate base of a N-methylphenylethanolaminium.
α-(Methylaminomethyl)benzyl alcohol is a potential substrate for studies involving phenylethanolamine-N-methyltransferase.
DL-ALPHA-(METHYLAMINOMETHYL)BENZYL ALCOHOL Basic Attributes
151.21
151.21
1072841
229-525-5
White
29221985
Characteristics
32.26000
0.71
Solid
1.02 g/cm3(Temp: 0 °C)
74-76 °C (lit.)
132-133 °C(Press: 15 Torr)
96.3±8.7 °C
1.537
14.03±0.20(Predicted)
2-8°C
Safety Information
NONH for all modes of transport
3
Xn
36
DO9625000
Xn
Stable. Incompatible with acids, acid chlorides, acid anhydrides, oxidizing agents.
P261, P264, P270, P271, P301+P312, P304+P312, P304+P340, P312, P330, P501
20/22
|Warning|H302 (90.7%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
DL-ALPHA-(METHYLAMINOMETHYL)BENZYL ALCOHOL Use and Manufacturing
α-(Methylaminomethyl)benzyl alcohol was used in the synthesis of 1,4-disubstituted-2,3,4,5-tetrahydro-1H-3-benzazepines. It was also used as internal standard during determination of pseudoephedrine and phenylpropanolamine urine concentrations by HPLC.
Computed Properties
Molecular Weight:151.21
XLogP3:-0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:151.099714038
Monoisotopic Mass:151.099714038
Topological Polar Surface Area:32.3
Heavy Atom Count:11
Complexity:99.7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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DL-ALPHA-(METHYLAMINOMETHYL)BENZYL ALCOHOL
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