2- (4-Methylphenyl) azetidine

CAT: 0926-VAC47180-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-VAC47180-01Size:50 mg

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CAS Number

1270471-80-1

MDL Number

MFCD18701771

Smiles

CC1=CC=C (C=C1) C2CCN2

Molecular Formula

C10H13N

Molecular Weight

147.22 g/mol

Controlled

Chemical Information

2-(4-Methylphenyl)azetidine

CAS Number	1270471-80-1
PubChem CID	55282313
IUPAC Name	2-(4-methylphenyl)azetidine
Molecular Formula	C10H13N
Molecular Weight	147.22
XLogP	1.8
Topological Polar Surface Area	12
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	125

SMILES

CC1=CC=C(C=C1)C2CCN2

InChI

InChI=1S/C10H13N/c1-8-2-4-9(5-3-8)10-6-7-11-10/h2-5,10-11H,6-7H2,1H3

InChIKey

CUTBEUSBJJIHHV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1270471-80-1

CID: 55282313

Formula: C10H13N

MW: 147.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	147.22
XLogP3	1.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	147.104799419
Monoisotopic Mass	147.104799419
Topological Polar Surface Area	12 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	125
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
FDD54017-01	3-[ (4-Methylphenyl) methyl]azetidine hydrochloride
PZC47200-01	3-Methyl-2- (3-methylphenyl) azetidine
PED65985-01	3-[ (2-Methylphenyl) methyl]azetidine hydrochloride
FF78691-01	2- (4-Fluorophenyl) azetidine
RXA19798-01	2- (4-Chlorophenyl) azetidine
PED67181-01	3-[ (3-Methylphenyl) methyl]azetidine hydrochloride
EEC95889-01	2- (4-Chlorophenyl) azetidine hydrochloride
SIC06215-01	2- (4-Bromophenyl) azetidine hydrochloride
UFC04230-01	2-[ (4-Methoxyphenyl) methyl]azetidine
WEA47613-01	4- (4-Amino-3-methylphenyl) -2-methylaniline 2-methylphenol

Catalog	Name
OR1097018-01	1,1-Dimethylethyl 3-[2-[ (4-methylphenyl) sulfonyl]hydrazinylidene]-1-azetidine...
268490-01	3- (4-Chlorophenyl) azetidine
TRC-F595310-500MG	3-(4-Fluorophenyl)azetidine
sc-344425A	3- (4-fluorobenzyl) azetidine
263265-01	3- (4-Bromophenyl) azetidine
OR1070742-01	3- (4-Methylbenzenesulfonyl) azetidine
PC107169	3- (4-Fluorophenoxy) azetidine
AR-A07865-01	2- (4-Methoxyphenyl) Azetidine
268354-01	3- (4-Chlorobenzyl) azetidine
408050-01	1- (4-Bromophenylsulfonyl) azetidine