(±)-Valinol
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(±)-Valinol
structure -
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CAS No:
16369-05-4
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Formula:
C5H13NO
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Chemical Name:
(±)-Valinol
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Synonyms:
1-Butanol,2-amino-3-methyl-;1-Butanol,2-amino-3-methyl-,DL-;1-Butanol,2-amino-3-methyl-,(±)-;2-Amino-3-methyl-1-butanol;(±)-Valinol;dl-Valinol;DL-Valinol;Valinol;3-Methyl-2-aminobutanol;[1-(Hydroxymethyl)-2-methylpropyl]amine;rac-Valinol;(±)-2-Amino-3-methyl-1-butanol;2-Amino-3-methylbutanol;N-(1-Hydroxy-3-methylbutan-2-yl)amine;473-75-6
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CAS No:
Characteristics
46.2
0
Clear yellow Liquid
0.936 g/mL at 25 °C(lit.)
31-32 °C
181-186 °C @ Press: 720 Torr
194 °F
n 20/D 1.4543(lit.)
Refrigerator (+4°C)
0.182mmHg at 25°C
Safety Information
2735
3
36/37/38
26-36/37
Xi
P261-P305 + P351 + P338
H315-H319-H335
|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 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|H315 (16.67%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|Aggregated GHS information provided by 52 companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:103.16
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:103.099714038
Monoisotopic Mass:103.099714038
Topological Polar Surface Area:46.2
Heavy Atom Count:7
Complexity:45.3
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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