2S CIS PNB(SIDE CHAIN) (CAS 96034-64-9) — formula C15H19N3O5S, molecular weight 353.4; category organic chemicals.
2S CIS PNB(SIDE CHAIN) is a carbon-based organic compound with CAS registry number 96034-64-9 and molecular formula C15H19N3O5S (molecular weight 353.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 96034-64-9
Its molecular formula C15H19N3O5S comprises 15 C, 19 H, 3 N, 5 O, 1 S atoms.
Also known as: 2S CIS PNB(SIDE CHAIN) · Side chain for meropenem
Category: organic chemicals
The CAS registry number of 2S CIS PNB(SIDE CHAIN) is 96034-64-9.
Molecular formula C15H19N3O5S, molecular weight 353.4.
It is also registered under: 2S CIS PNB(SIDE CHAIN), Side chain for meropenem.
Category: Organic Chemicals.
Public-database records for 2S CIS PNB(SIDE CHAIN) (CAS 96034-64-9), reproduced here for independent cross-checking.
| Reported hazard statements | H302 (100%), H315 (100%), H319 (100%), H335 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
| CAS Registry Number | 96034-64-9 |
|---|---|
| PubChem CID | 10871907 |
| 分子式 | C15H19N3O5S |
| IUPAC 名称 | (4-nitrophenyl)methyl (2S,4S)-2-(dimethylcarbamoyl)-4-sulfanylpyrrolidine-1-carboxylate |
(2S,4S)-2-(DIMETHYLAMINOCARBONYL)-4-MERCAPTO-1-(P-NITROBENZYLOXYCARBONYL)-1-PYRROLIDINE; (4-Nitrophenyl)methyl (2S,4S)-2-((dimethylamino)carbonyl)-4-mercapto-1-pyrrolidinecarboxylate; (4-Nitrophenyl)methyl (2S,4S)-2-[(dimethylamino)carbonyl]-4-mercapto-1-pyrrolidinecarboxylate; RefChem:398992; 619-190-7; 96034-64-9; (2S,4S)-4-Nitrobenzyl 2-(Dimethylcarbamoyl)-4-Mercaptopyrrolidine-1-Carboxylate; Side chain for meropenem; MFCD08063348; meropenem side chain; (4-Nitrophenyl)methyl (2S,4S)-2-(dimethylcarbamoyl)-4-sulfanylpyrrolidine-1-carboxylate; (2S,4S)-2-(DIMETHYLAMINOCARBONYL)-4-MERCAPTO-1-(P-NITROBENZYLOXYCARBONYL)PYRROLIDINE; 4-Nitrobenzyl (2S,4S)-2-(Dimethylcarbamoyl)-4-mercapto-1-pyrrolidinecarboxylate; 1-Pyrrolidinecarboxylic acid, 2-[(dimethylamino)carbonyl]-4-mercapto-,(4-nitrophenyl)methyl ester, (2S,4S)-; (2S,4S)-1-(p-nitrobenzyloxycarbonyl)-2-dimethylcarbamoyl-4-mercaptopyrrolidine; (2S,4S)-2-(Dimethylaminocarblnyl)-4-mercapto-1-(4'-nitrobenzyloxycarbonyl)-1-pyrrolidine
| 分子量 | 353.4 |
|---|---|
| XLogP3 | 1.5 |
| 氢键供体数 | 1 |
| 氢键受体数 | 6 |
| 可旋转键数 | 4 |
| 精确质量 | 353.10454189 |
| 单同位素质量 | 353.10454189 |
| 拓扑极性表面积 | 96.7 |
| 重原子数 | 24 |
| 形式电荷 | 0 |
2S CIS PNB(SIDE CHAIN) · CAS 96034-64-9 · C15H19N3O5S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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