Text Search
Structure Search

4-amino-1-(pyridin-3-yl)butan-1-one

4-amino-1-(pyridin-3-yl)butan-1-one

CAS: 71278-11-0

Formula: C9H12N2O

SMILES: NCCCC(=O)C1=CC=CN=C1

IUPAC: 4-amino-1-(pyridin-3-yl)butan-1-one

InChI: InChI=1S/C9H12N2O/c10-5-1-4-9(12)8-3-2-6-11-7-8/h2-3,6-7H,1,4-5,10H2

Composition: C (65.83%), H (7.37%), N (17.06%), O (9.74%)

Molar Mass: 164.208

Atom Count: 24

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 164.094963014
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey HFMNHVQBLYDLAJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 47.12
Topological Polar Surface Area 55.98
Polarizability 18.37
Ring Count 1
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
J&W PHARMLAB LLC
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
96% <2 Days 71278-11-0 $179.40-$4,597.70$179.40$243.80$373.75$631.35$1,147.70$4,597.70
Request Quote