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9H-fluoren-9-ylmethyl N-(3-bromopropyl)carbamate

9H-fluoren-9-ylmethyl N-(3-bromopropyl)carbamate

CAS: 186663-83-2

Formula: C18H18BrNO2

SMILES: BrCCCNC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12

IUPAC: (9H-fluoren-9-yl)methyl N-(3-bromopropyl)carbamate

InChI: InChI=1S/C18H18BrNO2/c19-10-5-11-20-18(21)22-12-17-15-8-3-1-6-13(15)14-7-2-4-9-16(14)17/h1-4,6-9,17H,5,10-12H2,(H,20,21)

Composition: C (60.01%), H (5.04%), Br (22.18%), N (3.89%), O (8.88%)

Molar Mass: 360.251

Atom Count: 40

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 359.052092
Formal Charge 0
FSP3 0.28
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey XWBHEIFHCNVXPS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 91.19
Topological Polar Surface Area 38.33
Polarizability 36.05
Ring Count 3
Rotatable Bond Count 6

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