tert-butyl N-[(1S)-1-(5-bromopyridin-2-yl)ethyl]carbamate

tert-butyl N-[(1S)-1-(5-bromopyridin-2-yl)ethyl]carbamate

CAS: 915720-71-7

Formula: C12H17BrN2O2

SMILES: C[C@H](NC(=O)OC(C)(C)C)C1=CC=C(Br)C=N1

IUPAC: tert-butyl N-[(1S)-1-(5-bromopyridin-2-yl)ethyl]carbamate

InChI: InChI=1S/C12H17BrN2O2/c1-8(10-6-5-9(13)7-14-10)15-11(16)17-12(2,3)4/h5-8H,1-4H3,(H,15,16)/t8-/m0/s1

Composition: C (47.86%), H (5.69%), Br (26.53%), N (9.30%), O (10.62%)

Molar Mass: 301.184

Atom Count: 34

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	300.047341
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	KPRNIARBGGDHDZ-QMMMGPOBSA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.84
Topological Polar Surface Area	51.22
Polarizability	27.06
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	915720-71-7		$103.40-$1,261.00$103.40$127.36$1,261.00