6-[(2R)-2-(methylamino)propyl]-2H-1,3-benzodioxol-4-ol hydrochloride

6-[(2R)-2-(methylamino)propyl]-2H-1,3-benzodioxol-4-ol hydrochloride

CAS: 1965314-67-3

Formula: C11H16ClNO3

SMILES: Cl.CN[C@H](C)CC1=CC(O)=C2OCOC2=C1

IUPAC: 6-[(2R)-2-(methylamino)propyl]-2H-1,3-benzodioxol-4-ol hydrochloride

InChI: InChI=1S/C11H15NO3.ClH/c1-7(12-2)3-8-4-9(13)11-10(5-8)14-6-15-11;/h4-5,7,12-13H,3,6H2,1-2H3;1H/t7-;/m1./s1

Composition: C (53.77%), H (6.56%), Cl (14.43%), N (5.70%), O (19.53%)

Molar Mass: 245.7

Atom Count: 32

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	245.0818711
Formal Charge	0
FSP3	0.45
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	VMMMAYRXDIZLDL-OGFXRTJISA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.23
Topological Polar Surface Area	50.72
Polarizability	22.22
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<2 Days	1965314-67-3		$327.75-$3,059.00$327.75$540.50$966.00$1,817.00$3,059.00$11,362.00