Cas no 61625-28-3 (Benzenecarboximidamide, 4-(4-methylbenzoyl)-)
61625-28-3 structure
Product Name:Benzenecarboximidamide, 4-(4-methylbenzoyl)-
CAS No:61625-28-3
MF:C15H14N2O
MW:238.284463405609
CID:472339
PubChem ID:12289400
Update Time:2025-04-19
Benzenecarboximidamide, 4-(4-methylbenzoyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenecarboximidamide, 4-(4-methylbenzoyl)-
- 4-(4-methylbenzoyl)benzenecarboximidamide
- 61625-28-3
- DTXSID70484797
-
- Inchi： 1S/C15H14N2O/c1-10-2-4-11(5-3-10)14(18)12-6-8-13(9-7-12)15(16)17/h2-9H,1H3,(H3,16,17)
- InChI Key： LXZUEXQNZDVGBQ-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC(C(=N)N)=CC=1)C1C=CC(C)=CC=1
Computed Properties
- Exact Mass: 238.11072
- Monoisotopic Mass: 238.110613074g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 311
- 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: 2.6
- Topological Polar Surface Area: 66.9?2
Experimental Properties
- PSA: 66.94
Benzenecarboximidamide, 4-(4-methylbenzoyl)- Related Literature
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
61625-28-3 (Benzenecarboximidamide, 4-(4-methylbenzoyl)-) Related Products
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