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Structure

2-Chlorophenothiazine

CAS
92-39-7
Catalog Number
ACM92397
Category
Other Products
Molecular Weight
233.72g/mol
Molecular Formula
C12H8ClNS

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Specification

IUPAC Name
2-chloro-10H-phenothiazine
Canonical 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
InChI Key
KFZGLJSYQXZIGP-UHFFFAOYSA-N
Complexity
236
Covalently-Bonded Unit Count
1
EC Number
202-152-5
Exact Mass
233.006598g/mol
Formal Charge
0
H-Bond Acceptor
2
H-Bond Donor
1
Heavy Atom Count
15
Monoisotopic Mass
233.006598g/mol
NSC Number
170953;67188;17469
Rotatable Bond Count
0
UNII
95H3AO2301
XLogP3
4.8
What is the PubChem CID of 2-Chlorophenothiazine?

PubChem CID 7088.

What is the molecular formula of 2-Chlorophenothiazine?

The molecular formula is C12H8ClNS.

What is the molecular weight of 2-Chlorophenothiazine?

The molecular weight is 233.72 g/mol.

What is the IUPAC name of 2-Chlorophenothiazine?

The IUPAC name is 2-chloro-10H-phenothiazine.

What is the InChI of 2-Chlorophenothiazine?

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

What is the InChIKey of 2-Chlorophenothiazine?

The InChIKey is KFZGLJSYQXZIGP-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Chlorophenothiazine?

The canonical SMILES is C1=CC=C2C(=C1)NC3=C(S2)C=CC(=C3)Cl.

What is the CAS number of 2-Chlorophenothiazine?

The CAS number is 92-39-7.

What is the European Community (EC) number of 2-Chlorophenothiazine?

The European Community (EC) number is 202-152-5.

How many hydrogen bond donor counts does 2-Chlorophenothiazine have?

2-Chlorophenothiazine has 1 hydrogen bond donor count.

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