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tert-butyl N-(3-bromonaphthalen-1-yl)carbamate

tert-butyl N-(3-bromonaphthalen-1-yl)carbamate

CAS: 1965310-45-5

Formula: C15H16BrNO2

SMILES: CC(C)(C)OC(=O)NC1=CC(Br)=CC2=CC=CC=C12

IUPAC: tert-butyl N-(3-bromonaphthalen-1-yl)carbamate

InChI: InChI=1S/C15H16BrNO2/c1-15(2,3)19-14(18)17-13-9-11(16)8-10-6-4-5-7-12(10)13/h4-9H,1-3H3,(H,17,18)

Composition: C (55.92%), H (5.01%), Br (24.80%), N (4.35%), O (9.93%)

Molar Mass: 322.202

Atom Count: 35

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 321.036442
Formal Charge 0
FSP3 0.27
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey YKEZLAPJHVPUBE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 80.42
Topological Polar Surface Area 38.33
Polarizability 31.61
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
96% <2 Days 1965310-45-5 $631.35-$4,597.70$631.35$1,147.70$4,597.70
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