Synonyms	NSC-26671 \| Tropintran \| ATROPINE SULFATE [WHO-DD] \| Sulfate d'atropine [French] \| Atropinsulfat [German] \| Atropisol \| Atropine (sulfate) \| UNII-KAE4PSB0Z3 \| Davurtrop \| Ichtho-bellol \| AI3-14072 \| Atropin siran [Czech] \| ATROPINE SULFATE ANHYDROUS [MI]
Specifications & Purity	≥98%
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads

Names and Identifiers

Pubchem Sid	504771805
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504771805
IUPAC Name	[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 3-hydroxy-2-phenylpropanoate;sulfuric acid
INCHI	InChI=1S/2C17H23NO3.H2O4S/c21-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12;1-5(2,3)4/h22-6,13-16,19H,7-11H2,1H3;(H2,1,2,3,4)/t2*13-,14+,15?,16?;
InChi Key	HOBWAPHTEJGALG-JKCMADFCSA-N
Canonical SMILES	CN1C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3.CN1C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3.OS(=O)(=O)O
Isomeric SMILES	CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)C(CO)C3=CC=CC=C3.CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)C(CO)C3=CC=CC=C3.OS(=O)(=O)O
PubChem CID	60196398
Molecular Weight	676.82

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

4 results found

Lot Number	Certificate Type	Date	Item
K2229101	Certificate of Analysis	Oct 09, 2022	A333140
D2401055	Certificate of Analysis	Oct 09, 2022	A333140
K2229038	Certificate of Analysis	Oct 09, 2022	A333140
K2229037	Certificate of Analysis	Oct 09, 2022	A333140

Melt Point(°C)	50.0° C
Molecular Weight	676.800 g/mol
XLogP3
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	10
Exact Mass	676.303 Da
Monoisotopic Mass	676.303 Da
Topological Polar Surface Area	183.000 Å²
Heavy Atom Count	47
Formal Charge	0
Complexity	434.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	3

Pictogram(s)	GHS06, GHS07
Signal	Danger
Hazard Statements	H302:Harmful if swallowed H300:Fatal if swallowed H330:Fatal if inhaled
Precautionary Statements	P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P260:Do not breathe dust/fume/gas/mist/vapors/spray. P284:[In case of inadequate ventilation] Wear respiratory protection. P271:Use only outdoors or in a well-ventilated area. P270:Do not eat, drink or smoke when using this product. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P330:Rinse mouth. P320:Specific treatment is urgent (see ... on this label). P301+P316:IF SWALLOWED: Get emergency medical help immediately. P301+P317:IF SWALLOWED: Get medical help. P316:Get emergency medical help immediately.
Merck Index	1.19097222222222

1. Yusheng Zhang, Xiaoyang Wu, Jie Ding, Borui Su, Zhihong Chen, Zhanwen Xiao, Chengheng Wu, Dan Wei, Jing Sun, Fang Luo, Huabing Yin, Hongsong Fan. (2023) Wireless-Powering Deep Brain Stimulation Platform Based on 1D-Structured Magnetoelectric Nanochains Applied in Antiepilepsy Treatment. ACS Nano, 17 (16): (15796–15809). [PMID:37530448] [10.1021/acsnano.3c03661]
2. Liang Meng, Pinjia Meng, Bugang Tang, Qingqing Zhang, Yanji Wang. (2013) Molecularly imprinted photonic hydrogels for fast screening of atropine in biological samples with high sensitivity. FORENSIC SCIENCE INTERNATIONAL, 231 (6). [PMID:23890610] [10.1016/j.forsciint.2013.04.008]

1. Yusheng Zhang, Xiaoyang Wu, Jie Ding, Borui Su, Zhihong Chen, Zhanwen Xiao, Chengheng Wu, Dan Wei, Jing Sun, Fang Luo, Huabing Yin, Hongsong Fan. (2023) Wireless-Powering Deep Brain Stimulation Platform Based on 1D-Structured Magnetoelectric Nanochains Applied in Antiepilepsy Treatment. ACS Nano, 17 (16): (15796–15809). [PMID:37530448] [10.1021/acsnano.3c03661]
2. Liang Meng, Pinjia Meng, Bugang Tang, Qingqing Zhang, Yanji Wang. (2013) Molecularly imprinted photonic hydrogels for fast screening of atropine in biological samples with high sensitivity. FORENSIC SCIENCE INTERNATIONAL, 231 (6). [PMID:23890610] [10.1016/j.forsciint.2013.04.008]

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