TCTU

CAT: 0862-GE3566-25gSize: 25 gDry Ice: NoHazardous: No

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CAT#:0862-GE3566-25gSize:25 g

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

330641-16-2

MDL Number

MFCD04973270

HS Code

29339980900

Purity

98.00%

Molecular Formula

C11H15BClF4N5O

Molecular Weight

355.53

Storage Conditions

+4°C

Hazardous Class

Not hazardous

Chemical Information

O-(6-Chlorobenzotriazol-1-yl)-N,N,N',N'-tetramethyluronium Tetrafluoroborate

CAS Number	330641-16-2
PubChem CID	24898642
IUPAC Name	[(6-chlorobenzotriazol-1-yl)oxy-(dimethylamino)methylidene]-dimethylazanium tetrafluoroborate
Molecular Formula	C11H15BClF4N5O
Molecular Weight	355.53
Topological Polar Surface Area	46.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	3
Heavy Atom Count	23
Formal Charge	0
Complexity	337

SMILES

[B-](F)(F)(F)F.CN(C)C(=[N+](C)C)ON1C2=C(C=CC(=C2)Cl)N=N1

InChI

InChI=1S/C11H15ClN5O.BF4/c1-15(2)11(16(3)4)18-17-10-7-8(12)5-6-9(10)13-14-17;2-1(3,4)5/h5-7H,1-4H3;/q+1;-1

InChIKey

GBGVQFJZGHBZMC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 330641-16-2

CID: 24898642

Formula: C11H15BClF4N5O

MW: 355.53

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	355.53
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	3
Exact Mass	355.0994306
Monoisotopic Mass	355.0994306
Topological Polar Surface Area	46.2 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	337
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	2
Compound Is Canonicalized	Yes

Catalog	Name
sc-251107A	TCTU
KTC-1010-PI-01	TCTU Reagent