(1S)-1-(4-methylphenyl)butan-1-amine hydrochloride

(1S)-1-(4-methylphenyl)butan-1-amine hydrochloride

CAS: 1391435-90-7

Formula: C11H18ClN

SMILES: Cl.CCC[C@H](N)C1=CC=C(C)C=C1

IUPAC: (1S)-1-(4-methylphenyl)butan-1-amine hydrochloride

InChI: InChI=1S/C11H17N.ClH/c1-3-4-11(12)10-7-5-9(2)6-8-10;/h5-8,11H,3-4,12H2,1-2H3;1H/t11-;/m0./s1

Composition: C (66.15%), H (9.08%), Cl (17.75%), N (7.01%)

Molar Mass: 199.72

Atom Count: 31

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	199.1127773
Formal Charge	0
FSP3	0.45
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	KBCFOUIIWWXJEI-MERQFXBCSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.12
Topological Polar Surface Area	26.02
Polarizability	21.05
Ring Count	1
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	1391435-90-7		$247.16-$358.12$247.16$358.12