Text Search
Structure Search

tert-butyl N-(2-fluoro-6-formylphenyl)carbamate

tert-butyl N-(2-fluoro-6-formylphenyl)carbamate

CAS: 844891-30-1

Formula: C12H14FNO3

SMILES: CC(C)(C)OC(=O)NC1=C(F)C=CC=C1C=O

IUPAC: tert-butyl N-(2-fluoro-6-formylphenyl)carbamate

InChI: InChI=1S/C12H14FNO3/c1-12(2,3)17-11(16)14-10-8(7-15)5-4-6-9(10)13/h4-7H,1-3H3,(H,14,16)

Composition: C (60.24%), H (5.90%), F (7.94%), N (5.85%), O (20.06%)

Molar Mass: 239.246

Atom Count: 31

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 239.095771478
Formal Charge 0
FSP3 0.33
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey OGTSMYJQTZJPRZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.15
Topological Polar Surface Area 55.4
Polarizability 23.06
Ring Count 1
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Struchem co.,ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 844891-30-1 $1,700.00-$2,860.00$1,700.00$2,200.00$2,860.00
Request Quote
J&W PHARMLAB LLC
Purity LeadTime CAS PacketSize UnitPrice
96% <2 Days 844891-30-1 $171.35-$2,748.50$171.35$227.70$342.70$457.70$687.70$2,748.50
Request Quote