tert-butyl N-[1-(4-fluorophenyl)-3-hydroxypropyl]carbamate

tert-butyl N-[1-(4-fluorophenyl)-3-hydroxypropyl]carbamate

CAS: 862466-16-8

Formula: C14H20FNO3

SMILES: CC(C)(C)OC(=O)NC(CCO)C1=CC=C(F)C=C1

IUPAC: tert-butyl N-[1-(4-fluorophenyl)-3-hydroxypropyl]carbamate

InChI: InChI=1/C14H20FNO3/c1-14(2,3)19-13(18)16-12(8-9-17)10-4-6-11(15)7-5-10/h4-7,12,17H,8-9H2,1-3H3,(H,16,18)

Composition: C (62.44%), H (7.49%), F (7.05%), N (5.20%), O (17.82%)

Molar Mass: 269.316

Atom Count: 39

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	269.142721671
Formal Charge	0
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	DUIAONVVNKFUPE-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	70.45
Topological Polar Surface Area	58.56
Polarizability	27.28
Ring Count	1
Rotatable Bond Count	6

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