4- (3-Fluoro-4-Nitrobenzyl) Morpholine

CAT: 0926-FF83196-01Size: 0.1 gDry Ice: NoHazardous: No

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CAT#:0926-FF83196-01Size:0.1 g

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CAS Number

552883-91-7

MDL Number

MFCD07368797

Smiles

C1COCCN1CC2=CC (=C (C=C2) [N+] (=O) [O-]) F

Molecular Formula

C11H13FN2O3

Molecular Weight

240.23 g/mol

Controlled

Chemical Information

4-[(3-Fluoro-4-nitrophenyl)methyl]morpholine

CAS Number	552883-91-7
PubChem CID	11276495
IUPAC Name	4-[(3-fluoro-4-nitrophenyl)methyl]morpholine
Molecular Formula	C11H13FN2O3
Molecular Weight	240.23
XLogP	1.3
Topological Polar Surface Area	58.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Heavy Atom Count	17
Formal Charge	0
Complexity	266

SMILES

C1COCCN1CC2=CC(=C(C=C2)[N+](=O)[O-])F

InChI

InChI=1S/C11H13FN2O3/c12-10-7-9(1-2-11(10)14(15)16)8-13-3-5-17-6-4-13/h1-2,7H,3-6,8H2

InChIKey

ACIOGCCQBJMRIE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 552883-91-7

CID: 11276495

Formula: C11H13FN2O3

MW: 240.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	240.23
XLogP3	1.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	240.09102044
Monoisotopic Mass	240.09102044
Topological Polar Surface Area	58.3 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	266
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
FF10251-01	4-Fluoro-3-nitrobenzyl alcohol
JMB60104-01	3-Fluoro-4- (morpholine-4-carbonyl) aniline
VIA95415-01	4- (3-Fluoro-5-nitrophenyl) morpholine
SAC43633-01	2- (4-Fluoro-3-methylphenyl) morpholine
BAC19634-01	2- (4-Fluoro-3-methoxyphenyl) morpholine
HNA40036-01	4- (4-Bromo-3-nitrobenzoyl) morpholine
IKB98775-01	3-Fluoro-5-nitrobenzyl bromide
WMB12565	2-Fluoro-3-nitrobenzyl bromide
EUB54373-01	3-Fluoro-2-nitrobenzyl bromide
IZB09370-01	4- (2-Fluoro-5-nitrophenyl) morpholine

Catalog	Name
OR110998-01	4- (4-Nitrobenzyl) morpholine
OR323222	N- (4-Methyl-3-nitrobenzyl) morpholine
OR312344	3- (Hydroxymethyl) -4- (3-nitrobenzyl) morpholine-3-carbonitrile
PC103716-01	4- (3-Fluoro-4-nitrophenyl) morpholine
PC1011171	4- (2-fluoro-3-methoxybenzyl) morpholine
sc-349501A	4-Fluoro-3- (morpholine-4-sulfonyl) -phenylamine
PC520330	4-[4- (Difluoromethyl) -3-fluoro-phenyl]morpholine
429826-01	4-[ (4-Fluoro-3-nitrobenzene) sulfonyl]morpholine
abx188468-01	4-Fluoro-3-(Morpholine-4-Carbonyl)Phenylboronic Acid
sc-349500	4-Fluoro-3- (morpholine-4-sulfonyl) -benzoic acid