AG00127N

136689-94-6 | 3-(2H-Tetrazol-5-yl)benzaldehyde

AG00127N

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	136689-94-6
Catalog Number	AG00127N(AGN-PC-0N64X4)
Chemical Name	3-(2H-Tetrazol-5-yl)benzaldehyde
IUPAC Name	3-(2H-tetrazol-5-yl)benzaldehyde
InChI	InChI=1S/C8H6N4O/c13-5-6-2-1-3-7(4-6)8-9-11-12-10-8/h1-5H,(H,9,10,11,12)
InChI Key	GWZICMAGCVWLAY-UHFFFAOYSA-N
MDL Number	MFCD08669914
Molecular Formula	C8H6N4O
Molecular Weight	174.1594
SMILES	O=CC1=CC=CC(C2=NNN=N2)=C1
Synonyms	3-(2H-tetrazol-5-yl)benzaldehyde, 136689-94-6, 3-(1H-TETRAZOL-5-YL)BENZALDEHYDE, CHEMBL3938481, 3-(1H-1,2,3,4-tetrazol-5-yl)benzaldehyde, Benzaldehyde, 3-(1H-tetrazol-5-yl)-, benzaldehyde, 3-(2H-tetrazol-5-yl)-, ACMC-1BZGL, AC1Q6PV6, SCHEMBL5318854, SCHEMBL13733284, 3-(tetrazol-5-yl)-benzaldehyde, CTK0G9904, CTK8E1761, GWZICMAGCVWLAY-UHFFFAOYSA-N, ALBB-014845, KS-00000B0C, ZX-AN013557, 3-(1H-Tetrazole-5-yl)benzaldehyde, 3-(1H-Tetrazol-5-yl)-benzaldehyde, BDBM50205573, MFCD18064602, ZINC38995967, AKOS005174633, AKOS006230338, FCH1411164, TRA0060876, AS-31217, SY012441, AB0064292, TC-307174, 3-(2H-1,2,3,4-tetrazol-5-yl)benzaldehyde, Z-4181, MFCD18064602 (95+%), I14-20154, CID10535227, 851069-97-1,

Complexity	187
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	174.054g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	174.163g/mol
Monoisotopic Mass	174.054g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	71.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number