Ethyl 2-(2-Methyl-2H-tetrazol-5-yl)acetate - CAS 89488-96-0

Name: Ethyl 2-(2-Methyl-2H-tetrazol-5-yl)acetate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB039507
Product Name:	Ethyl 2-(2-Methyl-2H-tetrazol-5-yl)acetate
CAS:	89488-96-0
Synonyms:	2-(2-methyl-5-tetrazolyl)acetic acid ethyl ester; ethyl 2-(2-methyltetrazol-5-yl)acetate

Technical Data

Patents

Computed Properties

IUPAC Name:	ethyl 2-(2-methyltetrazol-5-yl)acetate
Description:	Ethyl 2-(2-Methyl-2H-tetrazol-5-yl)acetate (CAS# 89488-96-0 ) is a useful research chemical.
Molecular Weight:	170.17
Molecular Formula:	C6H10N4O2
Canonical SMILES:	CCOC(=O)CC1=NN(N=N1)C
InChI:	InChI=1S/C6H10N4O2/c1-3-12-6(11)4-5-7-9-10(2)8-5/h3-4H2,1-2H3
InChI Key:	JTHBWNLNZDXTKP-UHFFFAOYSA-N
Boiling Point:	299.2 °C at 760 mmHg
Density:	1.33 g/cm³
LogP:	-0.68430

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Related Functional Groups

Carbonyl Compounds

[51493-02-8]C5H10ClNO
N-Methyl-N-propylcarbamoyl Chloride
[35153-16-3]C16H30O2
(Z)-10-Tetradecenyl Acetate
[55441-25-3]C8H7N3O
1-(2-Cyanophenyl)urea
[832741-29-4]C9H11BrOS
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[956439-56-8]C6H5N3O6
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[91552-11-3]C10H9ClO2
2-(3-Chlorophenyl)cyclopropanecarboxylic Acid

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US-2006293329-A1	Substituted enaminones, their derivatives and uses thereof	20050617

Complexity:	164
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	170.08037557
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	170.08037557
Rotatable Bond Count:	4
Topological Polar Surface Area:	69.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3