tert-butyl N-(6-bromo-2,3-dihydro-1H-inden-1-yl)carbamate

tert-butyl N-(6-bromo-2,3-dihydro-1H-inden-1-yl)carbamate

CAS: 1414958-70-5

Formula: C14H18BrNO2

SMILES: CC(C)(C)OC(=O)NC1CCC2=CC=C(Br)C=C12

IUPAC: tert-butyl N-(6-bromo-2,3-dihydro-1H-inden-1-yl)carbamate

InChI: InChI=1/C14H18BrNO2/c1-14(2,3)18-13(17)16-12-7-5-9-4-6-10(15)8-11(9)12/h4,6,8,12H,5,7H2,1-3H3,(H,16,17)

Composition: C (53.86%), H (5.81%), Br (25.59%), N (4.49%), O (10.25%)

Molar Mass: 312.207

Atom Count: 36

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	311.052092
Formal Charge	0
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	YZEZLDIZHPBHGQ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	74.61
Topological Polar Surface Area	38.33
Polarizability	29
Ring Count	2
Rotatable Bond Count	3

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