U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C10H14N3O.BF4
Molecular Weight 279.042
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(Ethyl(2-hydroxyethyl)amino)benzenediazonium tetrafluoroborate

SMILES

F[B-](F)(F)F.CCN(CCO)C1=CC=C(C=C1)[N+]#N

InChI

InChIKey=XLIWXKNHNMEGCP-UHFFFAOYSA-N
InChI=1S/C10H14N3O.BF4/c1-2-13(7-8-14)10-5-3-9(12-11)4-6-10;2-1(3,4)5/h3-6,14H,2,7-8H2,1H3;/q+1;-1

HIDE SMILES / InChI

Molecular Formula BF4
Molecular Weight 86.805
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C10H13N3O
Molecular Weight 191.2297
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 Sat Dec 16 12:36:02 GMT 2023
Edited
by admin
on Sat Dec 16 12:36:02 GMT 2023
Record UNII
RKH5C9EPL6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(Ethyl(2-hydroxyethyl)amino)benzenediazonium tetrafluoroborate
Systematic Name English
Benzenediazonium, 4-[ethyl(2-hydroxyethyl)amino]-, tetrafluoroborate(1-) (1:1)
Systematic Name English
Benzenediazonium, 4-[ethyl(2-hydroxyethyl)amino]-, tetrafluoroborate(1-)
Systematic Name English
Code System Code Type Description
CAS
69756-31-6
Created by admin on Sat Dec 16 12:36:02 GMT 2023 , Edited by admin on Sat Dec 16 12:36:02 GMT 2023
PRIMARY
EPA CompTox
DTXSID40220048
Created by admin on Sat Dec 16 12:36:02 GMT 2023 , Edited by admin on Sat Dec 16 12:36:02 GMT 2023
PRIMARY
FDA UNII
RKH5C9EPL6
Created by admin on Sat Dec 16 12:36:02 GMT 2023 , Edited by admin on Sat Dec 16 12:36:02 GMT 2023
PRIMARY
PUBCHEM
16205224
Created by admin on Sat Dec 16 12:36:02 GMT 2023 , Edited by admin on Sat Dec 16 12:36:02 GMT 2023
PRIMARY
ECHA (EC/EINECS)
274-103-6
Created by admin on Sat Dec 16 12:36:02 GMT 2023 , Edited by admin on Sat Dec 16 12:36:02 GMT 2023
PRIMARY