tert-butyl N-[(3-amino-4-fluorophenyl)methyl]carbamate

tert-butyl N-[(3-amino-4-fluorophenyl)methyl]carbamate

Formula: C12H17FN2O2

SMILES: CC(C)(C)OC(=O)NCC1=CC(N)=C(F)C=C1

IUPAC: tert-butyl N-[(3-amino-4-fluorophenyl)methyl]carbamate

InChI: InChI=1S/C12H17FN2O2/c1-12(2,3)17-11(16)15-7-8-4-5-9(13)10(14)6-8/h4-6H,7,14H2,1-3H3,(H,15,16)

Composition: C (59.99%), H (7.13%), F (7.91%), N (11.66%), O (13.32%)

Molar Mass: 240.278

Atom Count: 34

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	240.127405958
Formal Charge	0
FSP3	0.42
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	ZESPVVPBNKPRRE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.32
Topological Polar Surface Area	64.35
Polarizability	24.12
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C12H17FN2O2		Quote Only