4- (2,6-Dibromobenzyl) morpholine

CAT: 0127-OR1083415Size: 1 EachDry Ice: NoHazardous: No

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CAS Number

1414870-68-0

MDL Number

MFCD22628245

Smiles

C1ccc (c (c1Br) CN1CCOCC1) Br

Chemical Information

4-(2,6-Dibromobenzyl)morpholine

CAS Number	1414870-68-0
PubChem CID	74787769
IUPAC Name	4-[(2,6-dibromophenyl)methyl]morpholine
Molecular Formula	C11H13Br2NO
Molecular Weight	335.03
XLogP	2.8
Topological Polar Surface Area	12.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	15
Formal Charge	0
Complexity	187

SMILES

C1COCCN1CC2=C(C=CC=C2Br)Br

InChI

InChI=1S/C11H13Br2NO/c12-10-2-1-3-11(13)9(10)8-14-4-6-15-7-5-14/h1-3H,4-8H2

InChIKey

AJRIGFKDXUUREB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1414870-68-0

CID: 74787769

Formula: C11H13Br2NO

MW: 335.03

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	335.03
XLogP3	2.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	334.93434
Monoisotopic Mass	332.93639
Topological Polar Surface Area	12.5 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	187
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
OR71194-01	2,6-Dibromobenzyl bromide
OR2174-01	2,4-Dibromobenzyl alcohol
OR96323-01	2,6-Dibromobenzyl alcohol
OR45001-01	2,4-Dibromobenzyl bromide
PC502880-01	2,4-Dibromobenzyl fluoride
OR1083418	1- (2,6-Dibromobenzyl) piperidine
OR1096892	1- (2,6-Dibromobenzyl) pyrrolidine
OR13304	4- (2,4,6-Trinitrobenzoyl) morpholine
PC450204-01	4- (4,6-Difluoropyrimidin-2-yl) morpholine
OR33418-01	2,6-Dimethyl-4- (4-nitrophenyl) morpholine

Catalog	Name
TRC-M723729-250MG	2,2,6,6-d4-Morpholine
DXC61013-01	2,2,6-Trimethyl-6- (trifluoromethyl) morpholine
AFC47305-01	2-Cyclopentyl-6- (trifluoromethyl) morpholine
DXC60072-01	2,2-Dimethyl-6- (phenoxymethyl) morpholine
DJC03016-01	2,2-Dimethyl-6- (trifluoromethyl) morpholine
SQB48074-01	2- (2-Chloro-6-fluorophenyl) morpholine
422124-01	(2S,6S) -2,6-Dimethyl-morpholine
sc-322882	4- (6-Bromopyridin-2-yl) morpholine
YZB13775-01	4- (6-Fluoropyridin-2-yl) morpholine
SKB54820-01	4- (6-Bromopyridine-2-carbonyl) morpholine