2-Chlorophenothiazine

CAT: 0127-BUP16016-04Size: 2 gDry Ice: NoHazardous: No

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CAT#:0127-BUP16016-04Size:2 g

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CAS Number

92-39-7

Purity

=98%

Smiles

Clc1ccc2Sc3ccccc3Nc2c1

Chemical Information

2-Chlorophenothiazine

CAS Number	92-39-7
PubChem CID	7088
IUPAC Name	2-chloro-10H-phenothiazine
Molecular Formula	C12H8ClNS
Molecular Weight	233.72
XLogP	4.8
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	15
Formal Charge	0
Complexity	236

SMILES

C1=CC=C2C(=C1)NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C12H8ClNS/c13-8-5-6-12-10(7-8)14-9-3-1-2-4-11(9)15-12/h1-7,14H

InChIKey

KFZGLJSYQXZIGP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 92-39-7

CID: 7088

Formula: C12H8ClNS

MW: 233.72

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	233.72
XLogP3	4.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	233.0065981
Monoisotopic Mass	233.0065981
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	236
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
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Catalog	Name
FC20303-01	2-Chlorophenothiazine
HY-Y1749R-01	2-Chlorophenothiazine (Standard)
C16860-01	2-Chlorophenothiazine 95%
TRC-C370010-500MG	1-Chlorophenothiazine
TRC-C374985-1G	4-Chlorophenothiazine
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290342-01	2,2,2-Trifluoroethyl 2,5-bis (2,2,2-trifluoroethoxy) benzoate
TRC-T790240-50MG	2,2,2-Trifluoroethyl 2-Hydroxy-5-(2,2,2-trifluoroethoxy)benzoate
TRC-T790200-100MG	2,2,2-Trifluoroethyl 2,5-Bis(2,2,2-trifluoroethoxy)benzoate
022261	2,2,2-Trifluoroethyl 2-Hydroxy-5- (2,2,2-trifluoroethoxy) benzoate