4-Octyl-N-phenylaniline

CAT: 0926-FO182346Size: 500 gDry Ice: NoHazardous: No

1 / 1

CAT#:0926-FO182346Size:500 g

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

4175-37-5

Smiles

CCCCCCCCC1=CC=C (C=C1) NC2=CC=CC=C2

Molecular Formula

C20H27N

Molecular Weight

281.4 g/mol

Controlled

Chemical Information

4-Octyl-N-phenylaniline

CAS Number	4175-37-5
PubChem CID	61335
IUPAC Name	4-octyl-N-phenylaniline
Molecular Formula	C20H27N
Molecular Weight	281.4
XLogP	8.1
Topological Polar Surface Area	12
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	9
Heavy Atom Count	21
Formal Charge	0
Complexity	236

SMILES

CCCCCCCCC1=CC=C(C=C1)NC2=CC=CC=C2

InChI

InChI=1S/C20H27N/c1-2-3-4-5-6-8-11-18-14-16-20(17-15-18)21-19-12-9-7-10-13-19/h7,9-10,12-17,21H,2-6,8,11H2,1H3

InChIKey

DMLLDZGHGNLZNW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 4175-37-5

CID: 61335

Formula: C20H27N

MW: 281.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	281.4
XLogP3	8.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	9
Exact Mass	281.214349865
Monoisotopic Mass	281.214349865
Topological Polar Surface Area	12 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	236
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
DAA36581	N-Methyl-4-phenylaniline
UQB57569-01	4- (Aminomethyl) -N-ethyl-N-phenylaniline
LNA19016-01	4-Bromo-N-methyl-N-phenylaniline
IHB11408-01	2-Methoxy-4-methyl-N-phenylaniline
FO70194-01	N-Octyl 4-hydroxybenzoate
EAA53179-01	3-Nitro-N-phenylaniline
LCA61322-01	2-Bromo-N-phenylaniline
IFA99705-01	4- (n-Octyl) benzeneboronic acid
NCA01997-01	3-Methyl-4-phenylaniline
IJB68024-01	2-Iodo-4-phenylaniline

Catalog	Name
sc-482137	4-Octyl-N-phenylaniline
1205-71-6-01	4-Chloro-N-phenylaniline
433008	4-Methoxy-N-phenylaniline
330-83-6-01	4-Fluoro-N-phenylaniline
OR52337	4-Isopropyl-N-phenylaniline
OR75730-01	4-Bromo-N-phenylaniline
TRC-B810235-50MG	4-tert-Butyl-N-phenylaniline
OR1093826-01	4-iodo-N-methyl-N-phenylaniline
OR1070030-01	4-Bromo-N- (4-nitrophenyl) -N-phenylaniline
OR80654-01	2,4-Dimethyl-N-phenylaniline