CAS
94405-93-3 Purity
---
94405-93-3 Purity
---
Shopping basket
Methyl 4-[[(dimethylamino)carbonyl]thio]salicylate
CAS
94405-97-7
Catalog Number
ACM94405977
Category
Other Products
Molecular Weight
255.290220 [g/mol]
Molecular Formula
C11H13NO4S
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
EINECS 305-293-1, CID3024350, Methyl 4-(((dimethylamino)carbonyl)thio)salicylate, 94405-97-7
IUPAC Name
methyl 4-(dimethylcarbamoylsulfanyl)-2-hydroxybenzoate
SMILES
CN(C)C(=O)SC1=CC(=C(C=C1)C(=O)OC)O
InChI Key
JBLVMCUBAVQXCX-UHFFFAOYSA-N
Boiling Point
382.1ºC at 760mmHg
Flash Point
184.9ºC
Density
1.34g/cm³
EC Number
305-293-1
Exact Mass
255.05700
H-Bond Acceptor
4
H-Bond Donor
1
What is the molecular formula of Methyl 4-[[(dimethylamino)carbonyl]thio]salicylate?
The molecular formula is C11H13NO4S.
What is the molecular weight of Methyl 4-[[(dimethylamino)carbonyl]thio]salicylate?
The molecular weight is 255.29 g/mol.
What is the IUPAC name of Methyl 4-[[(dimethylamino)carbonyl]thio]salicylate?
The IUPAC name is methyl 4-(dimethylcarbamoylsulfanyl)-2-hydroxybenzoate.
What is the InChIKey of Methyl 4-[[(dimethylamino)carbonyl]thio]salicylate?
The InChIKey is JBLVMCUBAVQXCX-UHFFFAOYSA-N.
How many hydrogen bond donors does Methyl 4-[[(dimethylamino)carbonyl]thio]salicylate have?
It has 1 hydrogen bond donor count.
What is the topological polar surface area of Methyl 4-[[(dimethylamino)carbonyl]thio]salicylate?
The topological polar surface area is 92.1 Ų.
Is Methyl 4-[[(dimethylamino)carbonyl]thio]salicylate a canonicalized compound?
Yes, it is a canonicalized compound.
How many rotatable bond counts does Methyl 4-[[(dimethylamino)carbonyl]thio]salicylate have?
It has 4 rotatable bond counts.
What is the exact mass of Methyl 4-[[(dimethylamino)carbonyl]thio]salicylate?
The exact mass is 255.05652907 g/mol.
What is the complexity value of Methyl 4-[[(dimethylamino)carbonyl]thio]salicylate?
The complexity value is 295.
Please kindly note that our products are for research use only.
Recommended Products
CAS
94405-96-6 Purity
96%
94405-96-6 Purity
96%
