2,2-Diethyl-1,3-dioxaindan-5-amine

CAT: 0926-SCA48220-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-SCA48220-01Size:50 mg

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CAS Number

67482-20-6

MDL Number

MFCD18839085

Smiles

CCC1 (OC2=C (O1) C=C (C=C2) N) CC

Molecular Formula

C11H15NO2

Molecular Weight

193.24 g/mol

Controlled

Chemical Information

2,2-diethyl-2H-1,3-benzodioxol-5-amine

CAS Number	67482-20-6
PubChem CID	12445341
IUPAC Name	2,2-diethyl-1,3-benzodioxol-5-amine
Molecular Formula	C11H15NO2
Molecular Weight	193.24
XLogP	2.7
Topological Polar Surface Area	44.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	14
Formal Charge	0
Complexity	203

SMILES

CCC1(OC2=C(O1)C=C(C=C2)N)CC

InChI

InChI=1S/C11H15NO2/c1-3-11(4-2)13-9-6-5-8(12)7-10(9)14-11/h5-7H,3-4,12H2,1-2H3

InChIKey

ASRKBBBOOGTIHA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 67482-20-6

CID: 12445341

Formula: C11H15NO2

MW: 193.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	193.24
XLogP3	2.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	193.110278721
Monoisotopic Mass	193.110278721
Topological Polar Surface Area	44.5 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	203
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
ADA20074-01	2-Ethyl-2-methyl-1,3-dioxaindan-5-amine
GXA05368-01	2- (1,3-Dioxaindan-5-yl) propan-2-amine
WFA62855-01	2- (Trifluoromethyl) -1,3-dioxaindan-2-amine
YAA13147-01	2- (1,3-Dioxaindan-5-yl) -2-methylpropan-1-amine
GAA64235-01	(1,3-Dioxaindan-5-ylmethyl) (ethyl) amine
BHA90599-01	N-Cyclohexyl-1,3-dioxaindan-5-amine
RRA88318-01	N-Cyclooctyl-1,3-dioxaindan-5-amine
WYB72576-01	[2- (1,3-Dioxaindan-5-yl) propan-2-yl] (methyl) amine
DLA18365-01	2- (2,2-Difluoro-1,3-dioxaindan-5-yl) ethan-1-amine
AAA53310-01	[2- (1,3-Dioxaindan-5-yl) ethyl] (methyl) amine hydrochloride

Catalog	Name
OR1035641-01	(1,3-Dioxaindan-5-ylmethyl) (methyl) amine
PC111668-01	1- (1,3-Dioxaindan-5-yl) -2,2,2-trifluoroethan-1-one
OR1103085-01	3,5-Diethyl-4H-1,2,4-triazol-4-amine
437158-01	5,6-Diethyl-2,3-dihydro-1H-inden-2-amine
TRC-D444625-5G	Diethyl-[2-(3-nitrophenoxy)ethyl]amine
163810	Diethyl-[2- (3-nitrophenoxy) ethyl]amine
OR945260	N, N-Diethyl-5-nitropyridin-2-amine
OR345190	3-Bromo-n, n-diethyl-5-nitropyridin-2-amine
RG-E140823-01	N, N-diethyl-3-phenylbicyclo[2.2.1]heptan-2-amine
TRC-D444445-50MG	5,6-Diethyl-2,3-dihydro-1H-inden-2-amine Hydrochloride