CAS
91252-54-9 Purity
96%
91252-54-9 Purity
96%
Shopping basket
2-[(4-Chlorosulfonyl)phenyl]pyrimidine
CAS
912569-53-0
Catalog Number
ACM912569530
Category
Other Products
Molecular Weight
254.696
Molecular Formula
C10H7ClN2O2S
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
2-[(4-Chlorosulfonyl)phenyl]pyrimidine;4-Pyrimidin-2-ylbenzenesulfonyl chloride
IUPAC Name
4-pyrimidin-2-ylbenzenesulfonyl chloride
SMILES
C1=CN=C(N=C1)C2=CC=C(C=C2)S(=O)(=O)Cl
InChI Key
BPLYUKDYQDTCTE-UHFFFAOYSA-N
Boiling Point
310.7ºC at 760 mmHg
Melting Point
159.5-161.5ºC
Flash Point
141.7ºC
Density
1.432g/cm³
Exact Mass
253.99200
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of the compound?
The molecular formula of the compound is C10H7ClN2O2S.
What is the molecular weight of the compound?
The molecular weight of the compound is 254.69 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is 4-pyrimidin-2-ylbenzenesulfonyl chloride.
What is the InChIKey of the compound?
The InChIKey of the compound is BPLYUKDYQDTCTE-UHFFFAOYSA-N.
How many hydrogen bond acceptors are present in the compound?
There are 4 hydrogen bond acceptors present in the compound.
What is the topological polar surface area of the compound?
The topological polar surface area of the compound is 68.3 Å2.
Does the compound have a formal charge?
The compound has a formal charge of 0.
How many rotatable bond counts are present in the compound?
There are 2 rotatable bond counts present in the compound.
Is the compound canonicalized?
Yes, the compound is canonicalized.
When was the compound last modified?
The compound was last modified on December 30, 2023.
Please kindly note that our products are for research use only.
Recommended Products
CAS
912569-46-1 Purity
96%
912569-46-1 Purity
96%
CAS
912569-54-1 Purity
96%
912569-54-1 Purity
96%
CAS
912569-55-2 Purity
96%
912569-55-2 Purity
96%
