Ethyl 2-(5-chloro-1H-1,2,4-triazol-1-yl)propanoate - CAS 1823829-53-3
Catalog: |
BB052468 |
Product Name: |
Ethyl 2-(5-chloro-1H-1,2,4-triazol-1-yl)propanoate |
CAS: |
1823829-53-3 |
Synonyms: |
1H-1,2,4-Triazole-1-acetic acid, 5-chloro-α-methyl-, ethyl ester |
IUPAC Name: | ethyl 2-(5-chloro-1,2,4-triazol-1-yl)propanoate |
Molecular Weight: | 203.62 |
Molecular Formula: | C7H10ClN3O2 |
Canonical SMILES: | CCOC(=O)C(C)N1C(=NC=N1)Cl |
InChI: | InChI=1S/C7H10ClN3O2/c1-3-13-6(12)5(2)11-7(8)9-4-10-11/h4-5H,3H2,1-2H3 |
InChI Key: | SXUHAKMROQHWGZ-UHFFFAOYSA-N |
Boiling Point: | 326.2±44.0 °C at 760 mmHg |
Density: | 1.37±0.1 g/cm3 |
Complexity: | 191 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 203.0461543 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 203.0461543 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 57 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
-
Catalog: BB016679
5-(5-Bromo-2-thienyl)-1H-tetrazole solution
Detail
-
Catalog: BB014240
5-[(Benzyloxy)methyl]-2H-tetrazole
Detail
-
Catalog: BB005032
1-(1-Methyl-1H-1,2,4-triazol-5-yl)ethanamine
Detail
-
Catalog: BB005033
5-Bromo-3-(methoxymethyl)-1H-1,2,4-triazole
Detail
-
Catalog: BB013491
3,5-Dibromo-1-(methoxymethyl)-1H-1,2,4-triazole
Detail
-
Catalog: BB008309
Ethyl 1H-tetrazole-5-acetate
Detail
-
Catalog: BB010533
3-(Biphenyl-4-yl)-5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazole
Detail
-
Catalog: BB010432
1-methyl-1H-1,2,3-triazole-5-sulfonyl chloride
Detail
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Halides
Oxygen Compounds
Triazole/Tetrazole
-
[25537-64-8]
4,5-Dibromo-1-methyl-1,2,3-triazole
-
[13616-37-0]
Ethyl 1H-tetrazole-5-acetate
-
[86152-46-7]
Ethyl 2-(5-amino-4H-1,2,4-triazol-3-yl)acetate
-
[1823421-51-7]
Ethyl 2-(5-chloro-1H-1,2,4-triazol-1-yl)butanoate
-
[1823829-53-3]
Ethyl 2-(5-chloro-1H-1,2,4-triazol-1-yl)propanoate
-
[1823783-80-7]
Ethyl 4-(3-bromo-1H-1,2,4-triazol-1-yl)butanoate
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS