Text Search
Structure Search

5-(1,3-benzoxazol-2-yl)-2-chloroaniline

5-(1,3-benzoxazol-2-yl)-2-chloroaniline

CAS: 313701-55-2

Formula: C13H9ClN2O

SMILES: NC1=CC(=CC=C1Cl)C1=NC2=CC=CC=C2O1

IUPAC: 5-(1,3-benzoxazol-2-yl)-2-chloroaniline

InChI: InChI=1S/C13H9ClN2O/c14-9-6-5-8(7-10(9)15)13-16-11-3-1-2-4-12(11)17-13/h1-7H,15H2

Composition: C (63.82%), H (3.71%), Cl (14.49%), N (11.45%), O (6.54%)

Molar Mass: 244.68

Atom Count: 26

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 244.0403406
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey OQKDQHJUUGMNCC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 77.33
Topological Polar Surface Area 52.05
Polarizability 27.12
Ring Count 3
Rotatable Bond Count 1

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
90% <16 Days 313701-55-2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote
Crea-Chim UAB
Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 313701-55-2 $254.80$254.80
Request Quote