CAS
98532-69-5 Purity
---
98532-69-5 Purity
---
Inquiry Basket
Ethyl 5-chloro-1-(3-chlorophenyl)-1H-pyrazole-4-carboxylate
CAS
98534-74-8
Catalog Number
ACM98534748
Category
Other Products
Molecular Weight
285.126000 [g/mol]
Molecular Formula
C12H10Cl2N2O2
If you have any other questions or need other size, please get a quote.
- Product Description
- Case Study
- Custom Reviews
- Custom Q&A
- Synthetic Use
- Related Resources
Specification
Synonyms
98534-74-8, 5-CHLORO-1-(3-CHLOROPHENYL)-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER, ethyl 5-chloro-1-(3-chlorophenyl)-1H-pyrazole-4-carboxylate, AGN-PC-00O1RX, SureCN10340603, AKOS015900705, ACN-000087, AK139385, KB-245401, A11285, I14-15875, ethyl5-chloro-1-(3-chlorophenyl)-1H-pyrazole-4-carboxylate, 1H-Pyrazole-4-carboxylic acid, 5-chloro-1-(3-chlorophenyl)-, ethyl ester
IUPAC Name
ethyl 5-chloro-1-(3-chlorophenyl)pyrazole-4-carboxylate
Canonical SMILES
CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)Cl)Cl
InChI Key
CBWBLNNGPMXDKI-UHFFFAOYSA-N
Boiling Point
396.917ºC at 760 mmHg
Melting Point
55-57ºC
Flash Point
193.849ºC
Density
1.385g/cm³
Exact Mass
284.01200
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of the compound ethyl 5-chloro-1-(3-chlorophenyl)-1H-pyrazole-4-carboxylate?
The molecular formula is C12H10Cl2N2O2.
When was the compound created and last modified according to PubChem?
The compound was created on 2007-02-08 and last modified on 2023-12-30.
What is the IUPAC name of the compound?
The IUPAC name is ethyl 5-chloro-1-(3-chlorophenyl)pyrazole-4-carboxylate.
What is the InChIKey of the compound?
The InChIKey is CBWBLNNGPMXDKI-UHFFFAOYSA-N.
How many hydrogen bond donor counts does the compound have?
The compound has 0 hydrogen bond donor counts.
What is the exact mass of the compound?
The exact mass is 284.0119330 g/mol.
How many rotatable bond counts does the compound have?
The compound has 4 rotatable bond counts.
What is the complexity value of the compound?
The complexity value is 304.
Is the compound canonicalized according to PubChem?
Yes, the compound is canonicalized.
What is the topological polar surface area of the compound?
The topological polar surface area is 44.1 Å2.
Recommended Products
CAS
98534-81-7 Purity
96%
98534-81-7 Purity
96%
