2-[(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]butan-1-ol

2-[(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]butan-1-ol

Formula: C13H19NO3

SMILES: CCC(CO)NCC1=CC=C2OCCOC2=C1

IUPAC: 2-{[(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]amino}butan-1-ol

InChI: InChI=1/C13H19NO3/c1-2-11(9-15)14-8-10-3-4-12-13(7-10)17-6-5-16-12/h3-4,7,11,14-15H,2,5-6,8-9H2,1H3

Composition: C (65.80%), H (8.07%), N (5.90%), O (20.23%)

Molar Mass: 237.299

Atom Count: 36

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	237.136493476
Formal Charge	0
FSP3	0.54
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	HKZOFDWPBMDYHA-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.5
Topological Polar Surface Area	50.72
Polarizability	25.99
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H19NO3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00