CAS Number: 949109-36-8
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CAS Number
949109-36-8
PubChem CID
71489376
Molecular Formula
C17H25N3O6S
Molecular Weight
399.5 g/mol
Exact Mass
399.146407
InChIKey
ZIFXYEQQDVXSEN-ZDUSSCGKSA-N
IUPAC Name
tert-butyl (3S)-3-methyl-4-(2-nitrophenyl)sulfonyl-1,4-diazepane-1-carboxylate
SMILES String
C[C@H]1CN(C(=O)OC(C)(C)C)CCCN1S(=O)(=O)c1ccccc1[N+](=O)[O-]
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Structural features
(S)-tert-butyl 3-methyl-4-((2-nitrophenyl)sulfonyl)-1,4-diazepane-1-carboxylate (CAS 949109-36-8) is listed in the Pharmaceutical Intermediates portfolio, with molecular formula C17H25N3O6S and molecular weight 399. 50 g/mol.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Intended for research-stage medicinal chemistry and intermediate synthesis workflows; structure-derived tags include nitrogen-containing heterocycle.
Documentation needs
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Preliminary Safety Reference
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Safety Reference / SDS RequestCatalog navigation
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(S)-tert-butyl 3-methyl-4-((2-nitrophenyl)sulfonyl)-1,4-diazepane-1-carboxylate is identified by CAS 949109-36-8, with molecular formula C17H25N3O6S, molecular weight 399.5, InChIKey ZIFXYEQQDVXSEN-ZDUSSCGKSA-N.
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