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N-Methyl-2,3-dihydrobenzo[b][1,4]dioxine-6-methanamine

N-Methyl-2,3-dihydrobenzo[b][1,4]dioxine-6-methanamine - CAS 613656-45-4

Catalog:	BB031072
Product Name:	N-Methyl-2,3-dihydrobenzo[b][1,4]dioxine-6-methanamine
CAS:	613656-45-4
Synonyms:	1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylmethanamine; 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylmethanamine

Technical Data

Patents

Computed Properties

IUPAC Name:	1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylmethanamine
Description:	N-Methyl-2,3-dihydrobenzo[b][1,4]dioxine-6-methanamine (CAS# 613656-45-4) is a useful research chemical.
Molecular Weight:	179.22
Molecular Formula:	C10H13NO2
Canonical SMILES:	CNCC1=CC2=C(C=C1)OCCO2
InChI:	InChI=1S/C10H13NO2/c1-11-7-8-2-3-9-10(6-8)13-5-4-12-9/h2-3,6,11H,4-5,7H2,1H3
InChI Key:	SAGRVQMJUPNRRB-UHFFFAOYSA-N
MDL:	MFCD06260669
LogP:	1.56810

Publication Number	Title	Priority Date
WO-2021203811-A1	Benzothiazinone compound, preparation method therefor and application thereof as anti-tuberculosis drug	20200408
EP-3770148-A1	Receptor inhibitor, pharmaceutical composition comprising same, and use thereof	20180323
US-2021054007-A1	Receptor inhibitor, pharmaceutical composition comprising same, and use thereof	20180323
CN-108947952-B	2-substituted amino-5-trifluoromethyl-8-nitrobenz (thio) pyran-4-ketone compound and preparation method and application thereof	20170524
CN-108117534-B	Benzo-oxygenated aliphatic cyclomethylamines	20161129

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Complexity:	163
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	179.094628657
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	179.094628657
Rotatable Bond Count:	2
Topological Polar Surface Area:	30.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.2