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α-[(1S)-1-Aminoethyl]-α-phenylbenzenemethanol

α-[(1S)-1-Aminoethyl]-α-phenylbenzenemethanol structure

CAS No:
78603-91-5
Formula:
C15H17NO
Chemical Name:
α-[(1S)-1-Aminoethyl]-α-phenylbenzenemethanol
Synonyms:
Benzenemethanol,α-[(1S)-1-aminoethyl]-α-phenyl-;Benzenemethanol,α-(1-aminoethyl)-α-phenyl-,(S)-;α-[(1S)-1-Aminoethyl]-α-phenylbenzenemethanol;(S)-2-Amino-1,1-diphenyl-1-propanol;(S)-β-Hydroxy-α-methyl-β-phenylbenzeneethanamine;(2S)-2-Amino-1,1-diphenylpropan-1-ol;(S)-(-)-2-Amino-1,1-diphenyl-1-propanol
Categories:
Organic Chemistry > Nitrogen Compounds

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α-[(1S)-1-Aminoethyl]-α-phenylbenzenemethanol Basic Attributes

Molecular Weight：

227.3

Exact Mass：

227.30

EC Number：

622-109-8

DSSTox ID：

DTXSID50350522

HScode：

2922199090

Characteristics

PSA：

46.25000

XLogP3：

2.97000

Appearance：

white to light yellow crystal powder

Density：

1.112±0.06 g/cm3

Melting Point：

98-100 °C

Boiling Point：

407.8±40.0 °C(Predicted)

Flash Point：

200.4ºC

Refractive Index：

1.604

PKA：

11.25±0.50

Safety Information

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

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 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:227.30
XLogP3:2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:227.131014166
Monoisotopic Mass:227.131014166
Topological Polar Surface Area:46.2
Heavy Atom Count:17
Complexity:211
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 78603-91-5

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Guide of α-[(1S)-1-Aminoethyl]-α-phenylbenzenemethanol

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