1-Methoxy-4-nitrosobenzene

CAT: 0926-BAA51621-01Size: 5000 mgDry Ice: NoHazardous: No

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CAT#:0926-BAA51621-01Size:5000 mg

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CAS Number

1516-21-8

Synonyms

4-Nitrosoanisole

MDL Number

MFCD01674974

Molecular Formula

C7H7NO2

Molecular Weight

137.14 g/mol

Controlled

Chemical Information

1-Methoxy-4-nitrosobenzene

CAS Number	1516-21-8
PubChem CID	15197
IUPAC Name	1-methoxy-4-nitrosobenzene
Molecular Formula	C7H7NO2
Molecular Weight	137.14
XLogP	1.6
Topological Polar Surface Area	38.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	108

SMILES

COC1=CC=C(C=C1)N=O

InChI

InChI=1S/C7H7NO2/c1-10-7-4-2-6(8-9)3-5-7/h2-5H,1H3

InChIKey

RIOSDPIZGIWNMS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1516-21-8

CID: 15197

Formula: C7H7NO2

MW: 137.14

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	137.14
XLogP3	1.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	137.047678466
Monoisotopic Mass	137.047678466
Topological Polar Surface Area	38.7 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	108
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
DAA62323-01	1-Bromo-4-nitrosobenzene
QCA88200-01	2-Methyl-4-nitrosobenzene-1,3-diol
SCA56746-01	2- (Bromomethyl) -4-methoxy-1-nitrobenzene
KVB28310-01	1-Ethynyl-2-methoxy-4-nitrobenzene
CWB84408-01	2- (Azidomethyl) -1-methoxy-4-nitrobenzene
GDA79284-01	4-Methoxy-2-nitrobenzene-1-sulfonamide
XAA93993-01	4-Methoxy-3-nitrobenzene-1-sulfonamide
WEB63016-01	2-Methoxy-4-nitrobenzene-1-sulfonamide
TCA83796-01	4- (Chloromethyl) -2-methoxy-1-nitrobenzene
AAA09306-01	2- (Chloromethyl) -1-methoxy-4-nitrobenzene

Catalog	Name
CS-O-55207	1-Methoxy-4-nitrosobenzene
RG-A263182-01	1-Methyl-4-Nitrosobenzene
OR1078083	1-Bromo-4-nitrosobenzene
RG-A261672-01	1-Ethoxy-4-Nitrosobenzene
RG-F122130-01	1-Fluoro-4-Nitrosobenzene
HY-121641-01	Nitrosobenzene
N11840-01	Nitrosobenzene 97%
RG-E141754-01	1-bromo-2-nitrosobenzene
S-2740	Nitrosobenzene - 1ML
D290760	p-(Dimethylamino)nitrosobenzene