4-methoxybenzyl (6S)-7-amino-3-(chloromethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride (CAS 113479-65-5) — formula C16H18Cl2N2O4S, molecular weight 405.3; category organic chemicals.
| CAS Number | 113479-65-5 |
|---|---|
| Molecular Formula | C16H18Cl2N2O4S |
| Molecular Weight | 405.3 |
| Category | Organic Chemicals |
4-methoxybenzyl (6S)-7-amino-3-(chloromethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride is a carbon-based organic compound with CAS registry number 113479-65-5 and molecular formula C16H18Cl2N2O4S (molecular weight 405.3), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 113479-65-5
Its molecular formula C16H18Cl2N2O4S comprises 16 C, 18 H, 2 Cl, 2 N, 4 O, 1 S atoms.
Also known as: 4-methoxybenzyl (6S)-7-amino-3-(chloromethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride · 7-氨基-3-氯甲基-3-头孢唑啉-4-羧酸对甲氧苄盐酸盐
Category: organic chemicals
The CAS registry number of 4-methoxybenzyl (6S)-7-amino-3-(chloromethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride is 113479-65-5.
Molecular formula C16H18Cl2N2O4S, molecular weight 405.3.
It is also registered under: 4-methoxybenzyl (6S)-7-amino-3-(chloromethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride, 7-氨基-3-氯甲基-3-头孢唑啉-4-羧酸对甲氧苄盐酸盐.
Category: Organic Chemicals.
Independent reference data for 4-methoxybenzyl (6S)-7-amino-3-(chloromethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride (CAS 113479-65-5), compiled from public chemistry databases.
| CAS 号 | 113479-65-5 |
|---|---|
| PubChem CID | 14032024 |
| 分子式 | C16H18Cl2N2O4S |
| IUPAC 名称 | (4-methoxyphenyl)methyl (6R,7R)-7-amino-3-(chloromethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate;hydrochloride |
| Molecular Weight | 405.3 |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 404.0364336 |
| Monoisotopic Mass | 404.0364336 |
| Topological Polar Surface Area | 107 |
| Heavy Atom Count | 25 |
EC 601-254-0; RefChem:524736; 601-254-0; 113479-65-5; MFCD00191255; 7-Amino-3-chloromethyl-3-cephem-4-carboxylic acid p-methoxybenzyl ester hydrochloride; 7-Amino-3 chloromethyl-3-cephem-4-carboxylic Acid p-Methoxybenzyl Ester Hydrochloride; C16H18Cl2N2O4S; 4-methoxybenzyl 7beta-amino-3-chloromethyl-3-cephem-4-carboxylate hydrochloride; 7-Amino-3-chloromethyl-3-cephem-4-carboxylic acidp-methoxybenzyl ester hydrochloride; LYIIGHOYDRRHAJ-XRZFDKQNSA-N; ACLE HCL; Cefazolin Impurity 55; SCHEMBL3108183; DTXSID70554722; (6R,7R)-4-METHOXYBENZYL 7-AMINO-3-(CHLOROMETHYL)-8-OXO-5-THIA-1-AZABICYCLO[4.2.0]OCT-2-ENE-2-CARBOXYLATE HCL
| 已通报的危害声明 | H315 (100%), H317 (100%), H319 (100%), H334 (100%), H335 (100%) |
|---|
7-氨基-3-氯甲基-3-头孢唑啉-4-羧酸对甲氧苄盐酸盐 · CAS 113479-65-5 · C16H18Cl2N2O4S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.