Cas no 25978-54-5 (Guanidine,N-(4-aminobutyl)-N-(3-methyl-2-buten-1-yl)-)
25978-54-5 structure
Product Name:Guanidine,N-(4-aminobutyl)-N-(3-methyl-2-buten-1-yl)-
CAS No:25978-54-5
MF:C10H22N4
MW:198.308481693268
CID:255621
PubChem ID:117689
Update Time:2025-04-19
Guanidine,N-(4-aminobutyl)-N-(3-methyl-2-buten-1-yl)- Chemical and Physical Properties
Names and Identifiers
-
- Guanidine,N-(4-aminobutyl)-N-(3-methyl-2-buten-1-yl)-
- SPHEROPHYSINE
- 1-(4-aminobutyl)-1-(3-methylbut-2-en-1-yl)guanidine
- N-(4-Aminobutyl)-N-(3-methyl-2-butenyl)guanidine
- NS00050947
- Q27294398
- SPHEROPHYSINE [MI]
- Sphacrophysine
- N-(4-Aminobutyl)-N-(3-methyl-2-butenyl)guanidine #
- N-(4-Aminobutyl)-N-(3-methylbut-2-en-1-yl)guanidine
- BNYZYAWCGAEIKT-UHFFFAOYSA-N
- SCHEMBL3311141
- UNII-Y97J30G1VC
- Sphaerophysin
- Guanidine, N-(4-aminobutyl)-N-(3-methyl-2-butenyl)-
- 25978-54-5
- 1-(4-aminobutyl)-1-(3-methylbut-2-enyl)guanidine
- EINECS 247-385-3
- Y97J30G1VC
- Guanidine, N-(4-aminobutyl)-N-(3-methyl-2-buten-1-yl)-
- DTXSID40948876
-
- Inchi： 1S/C10H22N4/c1-9(2)5-8-14(10(12)13)7-4-3-6-11/h5H,3-4,6-8,11H2,1-2H3,(H3,12,13)
- InChI Key： BNYZYAWCGAEIKT-UHFFFAOYSA-N
- SMILES： N(C(=N)N)(C/C=C(\C)/C)CCCCN
Computed Properties
- Exact Mass: 198.18466
- Monoisotopic Mass: 198.18444672g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 7
- Complexity: 194
- 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: 0.5
- Topological Polar Surface Area: 79.1?2
Experimental Properties
- PSA: 79.13
Guanidine,N-(4-aminobutyl)-N-(3-methyl-2-buten-1-yl)- Related Literature
-
A. J. Birch,D. G. Pettit,R. Schofield J. Chem. Soc. 1957 410
-
Roberto G. S. Berlinck Nat. Prod. Rep. 2002 19 617
-
3. Index of subjects, 1957
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