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methyl (3R)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride

methyl (3R)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride

CAS: 146074-43-3

Formula: C11H14ClNO2

SMILES: Cl.COC(=O)[C@H]1CC2=CC=CC=C2CN1

IUPAC: methyl (3R)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride

InChI: InChI=1S/C11H13NO2.ClH/c1-14-11(13)10-6-8-4-2-3-5-9(8)7-12-10;/h2-5,10,12H,6-7H2,1H3;1H/t10-;/m1./s1

Composition: C (58.03%), H (6.20%), Cl (15.57%), N (6.15%), O (14.05%)

Molar Mass: 227.69

Atom Count: 29

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 227.0713064
Formal Charge 0
FSP3 0.36
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey BUXCBOUGBHWQBE-HNCPQSOCSA-N
Lipinski's Rule of Five 1
Molar Refractivity 53.21
Topological Polar Surface Area 38.33
Polarizability 21.09
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
96% <2 Days 146074-43-3 $143.75-$1,147.70$143.75$171.35$227.70$342.70$1,147.70
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