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tert-butyl N-(tert-butoxycarbonyl)-N-(2-chloro-5-methylpyridin-4-yl)carbamate

tert-butyl N-(tert-butoxycarbonyl)-N-(2-chloro-5-methylpyridin-4-yl)carbamate

CAS: 2803467-78-7

Formula: C16H23ClN2O4

SMILES: CC1=CN=C(Cl)C=C1N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

IUPAC: tert-butyl N-[(tert-butoxy)carbonyl]-N-(2-chloro-5-methylpyridin-4-yl)carbamate

InChI: InChI=1S/C16H23ClN2O4/c1-10-9-18-12(17)8-11(10)19(13(20)22-15(2,3)4)14(21)23-16(5,6)7/h8-9H,1-7H3

Composition: C (56.06%), H (6.76%), Cl (10.34%), N (8.17%), O (18.67%)

Molar Mass: 342.82

Atom Count: 46

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 342.1346349
Formal Charge 0
FSP3 0.56
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey XXGSDPSSMUBLKV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 88.31
Topological Polar Surface Area 68.73
Polarizability 34.26
Ring Count 1
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 2803467-78-7 $227.70-$1,147.70$227.70$342.70$457.70$687.70$1,147.70
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