Text Search
Structure Search

2-chloro-N-[2-(1H-indol-3-yl)ethyl]acetamide

2-chloro-N-[2-(1H-indol-3-yl)ethyl]acetamide

CAS: 52191-26-1

Formula: C12H13ClN2O

SMILES: ClCC(=O)NCCC1=CNC2=CC=CC=C12

IUPAC: 2-chloro-N-[2-(1H-indol-3-yl)ethyl]acetamide

InChI: InChI=1S/C12H13ClN2O/c13-7-12(16)14-6-5-9-8-15-11-4-2-1-3-10(9)11/h1-4,8,15H,5-7H2,(H,14,16)

Composition: C (60.89%), H (5.54%), Cl (14.98%), N (11.84%), O (6.76%)

Molar Mass: 236.7

Atom Count: 29

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 236.0716407
Formal Charge 0
FSP3 0.25
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 2
InChIKey VUOXPQXFKCXXFF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.57
Topological Polar Surface Area 44.89
Polarizability 25.92
Ring Count 2
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Key Organics Ltd
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 52191-26-1 $51.35-$86.31$51.35$63.37$86.31
Request Quote
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
98% <5 Days 52191-26-1 $42.87-$239.59$42.87$142.49$239.59
Request Quote