tert-butyl 2-amino-2-(pyridin-4-yl)acetate dihydrochloride

tert-butyl 2-amino-2-(pyridin-4-yl)acetate dihydrochloride

CAS: 1260638-12-7

Formula: C11H18Cl2N2O2

SMILES: Cl.Cl.CC(C)(C)OC(=O)C(N)C1=CC=NC=C1

IUPAC: tert-butyl 2-amino-2-(pyridin-4-yl)acetate dihydrochloride

InChI: InChI=1/C11H16N2O2.2ClH/c1-11(2,3)15-10(14)9(12)8-4-6-13-7-5-8;;/h4-7,9H,12H2,1-3H3;2*1H

Composition: C (46.99%), H (6.45%), Cl (25.22%), N (9.96%), O (11.38%)

Molar Mass: 281.18

Atom Count: 35

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 280.0745332
Formal Charge 0
FSP3 0.45
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey IYHXWOBOAFULJH-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.78
Topological Polar Surface Area 65.21
Polarizability 22.76
Ring Count 1
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
J&W PHARMLAB LLC
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 1260638-12-7 $342.70-$5,747.70$342.70$457.70$687.70$977.50$1,587.00$5,747.70
Request Quote