2-Aminomethyl-1,4-benzodioxane
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2-Aminomethyl-1,4-benzodioxane
structure -
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CAS No:
4442-59-5
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Formula:
C9H11NO2
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Chemical Name:
2-Aminomethyl-1,4-benzodioxane
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Synonyms:
1,4-Benzodioxin-2-methanamine,2,3-dihydro-;1,4-Benzodioxan-2-methylamine;1,4-Benzodioxan,2-(aminomethyl)-;2,3-Dihydro-1,4-benzodioxin-2-methanamine;Fourneau 946;2-Aminomethyl-1,4-benzodioxane;2-(Aminomethyl)-1,4-benzodioxan;LP 1;LP 1 (pharmaceutical);1,4-Benzodioxane-2-methylamine;2-Aminomethyl-2,3-dihydro-1,4-benzodioxin;[(2,3-Dihydro-1,4-benzodioxin-2-yl)methyl]amine;NSC 116045;N-[(2,3-Dihydrobenzo[1,4]dioxin-2-yl)methyl]amine;[(2,3-Dihydro-1,4-benzdioxin-2-yl)methyl]amine;(±)-2-(Aminomethyl)-1,4-benzodioxane;(2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methanamine;2,3-Dihydro-1,4-benzodioxin-2-ylmethanamine;(2,3-Dihydro-1,4-benzodioxin-2-yl)methanamine;2,3-Dihydro-1,4-benzodioxin-3-ylmethanamine;113830-01-6
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CAS No:
Characteristics
44.5
0.8
1.2±0.1 g/cm3
184-188 °C
127-137 °C @ Press: 4 Torr
124.1±28.8 °C
1.545
LDLo intravenous in rabbit: 60mg/kg
Safety Information
Ⅲ
2735
3
8
26-36/37/39
DF3676000
Xi
P261-P280-P305 + P351 + P338
H315-H318-H335
|Danger|H315 (97.5%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+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.
Computed Properties
Molecular Weight:165.19
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:165.078978594
Monoisotopic Mass:165.078978594
Topological Polar Surface Area:44.5
Heavy Atom Count:12
Complexity:152
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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