| CAS Number | 39051-77-9 |
| Catalog Number | AG00I7PR(AGN-PC-0WAEHW) |
| Chemical Name | n-carbamoyl-2-methylbenzenesulfonamide |
| IUPAC Name | (2-methylphenyl)sulfonylurea |
| InChI | InChI=1S/C8H10N2O3S/c1-6-4-2-3-5-7(6)14(12,13)10-8(9)11/h2-5H,1H3,(H3,9,10,11) |
| InChI Key | FHTLRVQASCAGSZ-UHFFFAOYSA-N |
| MDL Number | MFCD01231407 |
| Molecular Formula | C8H10N2O3S |
| Molecular Weight | 214.2416 |
| SMILES | CC1=C(S(NC(N)=O)(=O)=O)C=CC=C1 |
| Synonyms | N-CARBAMOYL-2-METHYL BENZENE SULFONAMIDE,
39051-77-9,
N-Carbamoyl-2-methylbenzenesulfonamide,
Tolyl-sulfonyl-harnstoff,
(2-methylphenyl)sulfonylurea,
SCHEMBL6465947,
FHTLRVQASCAGSZ-UHFFFAOYSA-N,
KS-000004UU,
MFCD01231407,
ZINC95627669,
AKOS025291008,
FCH1332512,
PB12732,
AK171121,
AS-34111,
CS-0048817,
N-(aminocarbonyl)-2 methylbenzenesulfonamide,
EN300-255184,
Q-3007,
N-Carbamoyl-2-methylbenzenesulfonamide (N-(Aminocarbonyl)-2-methylbenzenesulfonamide),
|
| Complexity | 307 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.239g/mol |
| Monoisotopic Mass | 214.041g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 97.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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