2-Methyl-1,3-dioxane-2-ethanamine

CAT: 0024-sc-483498Size: 500 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-483498Size:500 mg

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CAS Number

218602-40-5

Chemical Information

2-methyl-1,3-Dioxane-2-ethanamine

CAS Number	218602-40-5
PubChem CID	11116186
IUPAC Name	2-(2-methyl-1,3-dioxan-2-yl)ethanamine
Molecular Formula	C7H15NO2
Molecular Weight	145.20
XLogP	-0.2
Topological Polar Surface Area	44.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	10
Formal Charge	0
Complexity	99

SMILES

CC1(OCCCO1)CCN

InChI

InChI=1S/C7H15NO2/c1-7(3-4-8)9-5-2-6-10-7/h2-6,8H2,1H3

InChIKey

XTNTZIOFZXYZAB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 218602-40-5

CID: 11116186

Formula: C7H15NO2

MW: 145.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	145.20
XLogP3	-0.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	145.110278721
Monoisotopic Mass	145.110278721
Topological Polar Surface Area	44.5 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	99.8
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-305205	2- (3-Methoxypropoxy) -N-methyl-1-ethanamine
sc-305763	2- (5-Methyl-1,3-benzoxazol-2-yl) ethanamine
sc-339962	2- (4-methyl-1,3-thiazol-2-yl) ethanamine
sc-339962A	2- (4-methyl-1,3-thiazol-2-yl) ethanamine
sc-273781	2- (2-methyl-1,3-thiazol-4-yl) ethanamine
sc-487725	4-Methyl-1,3-dioxane
sc-342709A	2-fluoro-1- (3-methyl-1-benzofuran-2-yl) ethanamine
sc-342709	2-fluoro-1- (3-methyl-1-benzofuran-2-yl) ethanamine
sc-321046	2- (Cyclopropylmethoxy) -N-methyl-1-ethanamine
sc-273079	1- (5-methyl-2-furyl) ethanamine

Catalog	Name
282506-01	2-Methyl-1,3-dioxane-2-ethanamine
M010210	2-Methyl-1,3-dioxane
MBS5778932	1,3-Dioxane, 4-methyl-2-(2-phenylethenyl)-
GTR19224237-01	1,3-Dioxane, 4-methyl-2- (2-phenylethenyl) -
T29277-01	1,3-Dioxane, 2-hexyl-4-methyl-
MBS5778933	1,3-Dioxane, 4-methyl-2-phenyl-
OR1049158-01	4-Methyl-2-oxo-1,3-dioxane
T29280-01	1,3-Dioxane, 4-methyl-2-propyl-
OR322669	2- (3-Methyl-2-thienyl) ethanamine
OR93900-01	2- (2-Methyl-1,3-dioxolan-2-yl) ethanamine