Benzo[a]phenazine 12-Oxide

CAT: 0286-B03510Size: 1 gDry Ice: NoHazardous: No

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CAT#:0286-B03510Size:1 g

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CAS Number

18636-87-8

Pictogram

07 - Irritant

UDF Signal Word

Warning

MDL Number

MFCD00043580

Hazard Statement

H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.

DOT Name

Not D.O.T.-Regulated

Precautions

P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P310 IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

Benzo[a]phenazine 12-oxide

CAS Number	18636-87-8
PubChem CID	140406
IUPAC Name	12-oxidobenzo[a]phenazin-12-ium
Molecular Formula	C16H10N2O
Molecular Weight	246.26
XLogP	2.9
Topological Polar Surface Area	38.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	19
Formal Charge	0
Complexity	335

SMILES

C1=CC=C2C(=C1)C=CC3=NC4=CC=CC=C4[N+](=C32)[O-]

InChI

InChI=1S/C16H10N2O/c19-18-15-8-4-3-7-13(15)17-14-10-9-11-5-1-2-6-12(11)16(14)18/h1-10H

InChIKey

QOEUHFSHKLIUGS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 18636-87-8

CID: 140406

Formula: C16H10N2O

MW: 246.26

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	246.26
XLogP3	2.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	246.079312947
Monoisotopic Mass	246.079312947
Topological Polar Surface Area	38.4 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	335
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

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Catalog	Name
OR1043595	Benzo[a]phenazine 12-Oxide
MBS5775675	Phenazine oxide
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sc-268553	Benzo[c]cinnoline N-oxide
OR1011748-01	5,12-Dihydroquinoxalino[2,3-B]Phenazine
sc-227320	Benzo-12-crown-4
DAA06712-01	Benzo[A]pyrene-6,12-quinone
sc-227321	Benzo[a]anthracene-7,12-dione
TRC-B203485-1G	Benzo[k]fluoranthene-7,12-dicarbonitrile
OR1041037-01	12-Phenyl-12H-benzo[b]phenothiazine

Benzo[a]phenazine 12-Oxide

Chemical Information

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