Text Search
Structure Search

2-methyl-4-(3-phenylpropoxy)aniline

2-methyl-4-(3-phenylpropoxy)aniline

CAS: 946742-66-1

Formula: C16H19NO

SMILES: CC1=C(N)C=CC(OCCCC2=CC=CC=C2)=C1

IUPAC: 2-methyl-4-(3-phenylpropoxy)aniline

InChI: InChI=1S/C16H19NO/c1-13-12-15(9-10-16(13)17)18-11-5-8-14-6-3-2-4-7-14/h2-4,6-7,9-10,12H,5,8,11,17H2,1H3

Composition: C (79.63%), H (7.94%), N (5.80%), O (6.63%)

Molar Mass: 241.334

Atom Count: 37

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 241.146664236
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey TUWHUOMKRAFPMC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 76.23
Topological Polar Surface Area 35.25
Polarizability 28.99
Ring Count 2
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
MATRIX SCIENTIFIC
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 946742-66-1 $219.25$219.25
Request Quote