Cas no 4909-18-6 (Carbamic acid,(3-methoxypropyl)-, p-methoxyphenyl ester (7CI,8CI))
4909-18-6 structure
Product Name:Carbamic acid,(3-methoxypropyl)-, p-methoxyphenyl ester (7CI,8CI)
CAS No:4909-18-6
MF:C20H22N4O4
MW:382.413084506989
CID:333621
PubChem ID:300946
Update Time:2025-04-19
Carbamic acid,(3-methoxypropyl)-, p-methoxyphenyl ester (7CI,8CI) Chemical and Physical Properties
Names and Identifiers
-
- Carbamic acid,(3-methoxypropyl)-, p-methoxyphenyl ester (7CI,8CI)
- 2-[2-(5,6-dimethoxy-1H-benzimidazol-2-yl)ethyl]-5,6-dimethoxy-1H-benzimidazole
- NSC176659
- NSC-176659
- CHEMBL1901936
- NCGC00188232-01
- 4909-18-6
- DTXSID00306458
- 1H-Benzimidazole, 2,2'-(1,2-ethanediyl)bis[5,6-dimethoxy-
-
- Inchi： 1S/C20H22N4O4/c1-25-15-7-11-12(8-16(15)26-2)22-19(21-11)5-6-20-23-13-9-17(27-3)18(28-4)10-14(13)24-20/h7-10H,5-6H2,1-4H3,(H,21,22)(H,23,24)
- InChI Key： OMUNAGZLLHKPOT-UHFFFAOYSA-N
- SMILES： O(C)C1C(=CC2=C(C=1)NC(CCC1=NC3C=C(C(=CC=3N1)OC)OC)=N2)OC
Computed Properties
- Exact Mass: 382.16410520g/mol
- Monoisotopic Mass: 382.16410520g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 28
- Rotatable Bond Count: 7
- Complexity: 469
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.2
- Topological Polar Surface Area: 94.3?2
Carbamic acid,(3-methoxypropyl)-, p-methoxyphenyl ester (7CI,8CI) Related Literature
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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