Cas no 57323-76-9 (Benzenecarboximidamide, 4-(phenoxymethyl)-)
57323-76-9 structure
Product Name:Benzenecarboximidamide, 4-(phenoxymethyl)-
CAS No:57323-76-9
MF:C14H14N2O
MW:226.273763179779
CID:345776
PubChem ID:12222235
Update Time:2025-04-19
Benzenecarboximidamide, 4-(phenoxymethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenecarboximidamide, 4-(phenoxymethyl)-
- 4-(phenoxymethyl)benzenecarboximidamide
- AKOS000178040
- AB01111312-03
- 57323-76-9
- NCGC00335266-01
- CHEMBL2418043
- BDBM50010079
- 4-(phenoxymethyl)benzamidine
- DTXSID20481150
-
- Inchi： 1S/C14H14N2O/c15-14(16)12-8-6-11(7-9-12)10-17-13-4-2-1-3-5-13/h1-9H,10H2,(H3,15,16)
- InChI Key： PWIUJBQMPRRSIX-UHFFFAOYSA-N
- SMILES： O(C1C=CC=CC=1)CC1C=CC(C(=N)N)=CC=1
Computed Properties
- Exact Mass: 226.11072
- Monoisotopic Mass: 226.110613074g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 241
- 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: 2.8
- Topological Polar Surface Area: 59.1?2
Experimental Properties
- PSA: 59.1
Benzenecarboximidamide, 4-(phenoxymethyl)- Related Literature
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
57323-76-9 (Benzenecarboximidamide, 4-(phenoxymethyl)-) Related Products
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