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Details

Stereochemistry ACHIRAL
Molecular Formula C18H22N3S.Cl
Molecular Weight 347.905
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIMETHYLMETHYLENE BLUE CHLORIDE

SMILES

[Cl-].CN(C)C1=CC2=[S+]C3=C(N=C2C(C)=C1)C(C)=CC(=C3)N(C)C

InChI

InChIKey=JRMSLDWZFJZLAS-UHFFFAOYSA-M
InChI=1S/C18H22N3S.ClH/c1-11-7-13(20(3)4)9-15-17(11)19-18-12(2)8-14(21(5)6)10-16(18)22-15;/h7-10H,1-6H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C18H22N3S
Molecular Weight 312.452
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:59:22 GMT 2023
Edited
by admin
on Fri Dec 15 17:59:22 GMT 2023
Record UNII
U99510HTUM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIMETHYLMETHYLENE BLUE CHLORIDE
Common Name English
1,9-DIMETHYLMETHYLENE BLUE
Common Name English
Code System Code Type Description
PUBCHEM
123898
Created by admin on Fri Dec 15 17:59:22 GMT 2023 , Edited by admin on Fri Dec 15 17:59:22 GMT 2023
PRIMARY
FDA UNII
U99510HTUM
Created by admin on Fri Dec 15 17:59:22 GMT 2023 , Edited by admin on Fri Dec 15 17:59:22 GMT 2023
PRIMARY
CAS
23481-50-7
Created by admin on Fri Dec 15 17:59:22 GMT 2023 , Edited by admin on Fri Dec 15 17:59:22 GMT 2023
PRIMARY
ECHA (EC/EINECS)
245-683-8
Created by admin on Fri Dec 15 17:59:22 GMT 2023 , Edited by admin on Fri Dec 15 17:59:22 GMT 2023
PRIMARY
EPA CompTox
DTXSID10178047
Created by admin on Fri Dec 15 17:59:22 GMT 2023 , Edited by admin on Fri Dec 15 17:59:22 GMT 2023
PRIMARY