tert-butyl N-[(6-chloropyrimidin-4-yl)methyl]carbamate

tert-butyl N-[(6-chloropyrimidin-4-yl)methyl]carbamate

CAS: 1389264-32-7

Formula: C10H14ClN3O2

SMILES: CC(C)(C)OC(=O)NCC1=NC=NC(Cl)=C1

IUPAC: tert-butyl N-[(6-chloropyrimidin-4-yl)methyl]carbamate

InChI: InChI=1S/C10H14ClN3O2/c1-10(2,3)16-9(15)12-5-7-4-8(11)14-6-13-7/h4,6H,5H2,1-3H3,(H,12,15)

Composition: C (49.29%), H (5.79%), Cl (14.55%), N (17.24%), O (13.13%)

Molar Mass: 243.69

Atom Count: 30

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	243.0774544
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	SLVHELJLPHOMLT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	61.41
Topological Polar Surface Area	64.11
Polarizability	23.5
Ring Count	1
Rotatable Bond Count	4

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