3- (Methylnitrosoamino) phenol

CAT: 1299-RG-E140366-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RG-E140366-01Size:10 mg

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CAS Number

23040-64-4

Synonyms

N- (3-hydroxyphenyl) -N-methylnitrous amide

Molecular Formula

C7H8N2O2

Molecular Weight

152.15

Product Name Synonym

N- (3-hydroxyphenyl) -N-methylnitrous amide

Chemical Information

Phenol, m-(methylnitrosamino)-

CAS Number	23040-64-4
PubChem CID	146730
IUPAC Name	N-(3-hydroxyphenyl)-N-methylnitrous amide
Molecular Formula	C7H8N2O2
Molecular Weight	152.15
XLogP	1.3
Topological Polar Surface Area	52.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	140

SMILES

CN(C1=CC(=CC=C1)O)N=O

InChI

InChI=1S/C7H8N2O2/c1-9(8-11)6-3-2-4-7(10)5-6/h2-5,10H,1H3

InChIKey

XFRTWRMEJVWCTE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 23040-64-4

CID: 146730

Formula: C7H8N2O2

MW: 152.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	152.15
XLogP3	1.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	152.058577502
Monoisotopic Mass	152.058577502
Topological Polar Surface Area	52.9 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	140
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
RG-A262118-01	3- (Methylnitrosoamino) Propanenitrile
RG-M052005-01	4- (Methylnitrosoamino) -1- (3-Pyridinyl) -1-Butanone (Nnk)
RG-A261422-01	3- (Chloromethyl) Phenol
RG-T180969-01	3- (Trifluoromethyl) Phenol
RG-F122154-01	3-Fluoro-4- (Trifluoromethyl) Phenol
RG-A262075-01	3-Chloro-4- (Hydroxyamino) Phenol
RG-A262426-01	Phenol-D
RG-E141064-01	4-[3- (Trifluoromethyl) -3H-diazirin-3-yl]phenol
RG-E140951-01	4- (2- ((3,3-diphenylpropyl) amino) propyl) phenol
RG-E140774-01	(S) -3- (2- (ethylamino) -1-hydroxyethyl) phenol

Catalog	Name
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