Cas no 748723-00-4 (Benzenecarboximidamide,3,4-diethoxy-)
748723-00-4 structure
Product Name:Benzenecarboximidamide,3,4-diethoxy-
CAS No:748723-00-4
MF:C11H16N2O2
MW:208.256942749023
CID:561128
PubChem ID:28702356
Update Time:2025-04-19
Benzenecarboximidamide,3,4-diethoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzenecarboximidamide,3,4-diethoxy-
- Benzenecarboximidamide, 3,4-diethoxy- (9CI)
- AKOS010647791
- 3,4-Diethoxybenzimidamide
- 748723-00-4
-
- Inchi： 1S/C11H16N2O2/c1-3-14-9-6-5-8(11(12)13)7-10(9)15-4-2/h5-7H,3-4H2,1-2H3,(H3,12,13)
- InChI Key： RTBQHMGPIWAPOH-UHFFFAOYSA-N
- SMILES： O(CC)C1C=C(C(=N)N)C=CC=1OCC
Computed Properties
- Exact Mass: 208.12100
- Monoisotopic Mass: 208.121
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 209
- 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: 1.8
- Topological Polar Surface Area: 68.3A^2
Experimental Properties
- PSA: 68.33000
- LogP: 2.56810
Benzenecarboximidamide,3,4-diethoxy- Related Literature
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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