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(αS)-α-[(1S)-1-Amino-2-methoxyethyl]benzenemethanol

(αS)-α-[(1S)-1-Amino-2-methoxyethyl]benzenemethanol structure

CAS No:
51594-34-4
Formula:
C10H15NO2
Chemical Name:
(αS)-α-[(1S)-1-Amino-2-methoxyethyl]benzenemethanol
Synonyms:
Benzenemethanol,α-[(1S)-1-amino-2-methoxyethyl]-,(αS)-;Benzenemethanol,α-(1-amino-2-methoxyethyl)-,[S-(R*,R*)]-;(αS)-α-[(1S)-1-Amino-2-methoxyethyl]benzenemethanol;(1S,2S)-(+)-2-Amino-3-methoxy-1-phenyl-1-propanol;(+)-2-Amino-3-methoxy-1-phenyl-1-propanol;(1S,2S)-2-Amino-3-methoxy-1-phenylpropan-1-ol;(1S,2S)-2-Amino-3-methoxy-1-phenylpropan-1-ol
Categories:
Biochemical Engineering > Amino Acids and Derivatives

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(αS)-α-[(1S)-1-Amino-2-methoxyethyl]benzenemethanol Basic Attributes

Molecular Weight：

181.23

Exact Mass：

181.23

DSSTox ID：

DTXSID00415938

HScode：

2922509090

Characteristics

PSA：

55.5

XLogP3：

1.39400

Density：

1.105g/cm3

Melting Point：

48-50 °C @ Solvent: Diethyl ether

Boiling Point：

325.5ºC at 760 mmHg

Flash Point：

>230 °F

Refractive Index：

1.545

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|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:181.23
XLogP3:0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:181.110278721
Monoisotopic Mass:181.110278721
Topological Polar Surface Area:55.5
Heavy Atom Count:13
Complexity:135
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (αS)-α-[(1S)-1-Amino-2-methoxyethyl]benzenemethanol

Basic Attributes
Characteristics
Safety Information
Computed Properties
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(αS)-α-[(1S)-1-Amino-2-methoxyethyl]benzenemethanol

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