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(1S)-1-(2,4,6-trimethylphenyl)ethanamine hydrochloride

(1S)-1-(2,4,6-trimethylphenyl)ethanamine hydrochloride

CAS: 2227804-07-9

Formula: C11H18ClN

SMILES: Cl[H].C[C@H](N)C1=C(C)C=C(C)C=C1C

IUPAC: (1S)-1-(2,4,6-trimethylphenyl)ethan-1-amine hydrochloride

InChI: InChI=1S/C11H17N.ClH/c1-7-5-8(2)11(10(4)12)9(3)6-7;/h5-6,10H,12H2,1-4H3;1H/t10-;/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 VFBGENMGPYITQS-PPHPATTJSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.07
Topological Polar Surface Area 26.02
Polarizability 20.89
Ring Count 1
Rotatable Bond Count 1

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