N-(4-methoxybenzyl)methanesulfonamide
Basic information
- CAS
42060-31-1- Standard SMILES
COc1ccc(CNS(C)(=O)=O)cc1- InChIKey
OFSFIXASTARXSY-UHFFFAOYSA-N- Molecular formula
- C9H13NO3S
- Average molar mass
- 215.27 g/mol
- Monoisotopic mass
- 215.06161445
Names & identifiers
- Preferred name
- N-(4-methoxybenzyl)methanesulfonamide
- IUPAC
- N-[(4-methoxyphenyl)methyl]methanesulfonamide
- English name
- N-[(4-Methoxyphenyl)Methyl]Methanesulfonamide
- Molecular formula
- C9H13NO3S
- Molecular weight
- 215.26942
Names & synonyms
42060-31-1N-(4-methoxybenzyl)methanesulfonamideN-[(4-methoxyphenyl)methyl]methanesulfonamideMFCD01212931Methanesulfonamide, N-[(4-methoxyphenyl)methyl]-ZINC29506ZINC00029506SCHEMBL1530297SCHEMBL2839142COc1ccc(cc1)CNS(=O)(=O)COFSFIXASTARXSY-UHFFFAOYSA-NHMS5161B08
Show more names
N-[(4-Methoxyphenyl)Methyl]Methanesulfonamide(WXC03558)
SBA06031STK077132AKOS000431147GS-0412SB79544N-(4-methoxy-benzyl)-methanesulfonamideDA-05962N(4METHOXYBENZYL)METHANESULFONAMIDE
Database identifiers
- CAS
42060-31-1- PubChem CID
- 669028
- EC Number
- 185-675-0
- Nikkaji
- J2.385.416C
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 63.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 250
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
7 records
Compound notes
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