Cas no 17463-28-4 (butan-1-amine; octanoic acid)
butan-1-amine; octanoic acid structure
Product Name:butan-1-amine; octanoic acid
CAS No:17463-28-4
MF:C12H27NO2
MW:217.348284006119
CID:182926
PubChem ID:167657
Update Time:2025-04-19
butan-1-amine; octanoic acid Chemical and Physical Properties
Names and Identifiers
-
- butan-1-amine,octanoic acid
- Octanoic acid, compd. with 1-butanamine (1:1)
- AC1L50CQ
- AC1Q5W55
- AG-J-33291
- AR-1K8980
- butan-1-amine
- butylammonium octanoate
- CTK0H9258
- octanoic acid
- Octanoic acid, compd. with N-butylamine (1:1)
- butan-1-amine;octanoic acid
- 17463-28-4
- DTXSID4066200
- SCHEMBL9615342
- butan-1-amine; octanoic acid
-
- Inchi： 1S/C8H16O2.C4H11N/c1-2-3-4-5-6-7-8(9)10;1-2-3-4-5/h2-7H2,1H3,(H,9,10);2-5H2,1H3
- InChI Key： SGTADWDVCKFNIU-UHFFFAOYSA-N
- SMILES： OC(CCCCCCC)=O.NCCCC
Computed Properties
- Exact Mass: 217.20431
- Monoisotopic Mass: 217.204
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 8
- Complexity: 102
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 63.3?2
Experimental Properties
- Density: g/cm3
- Boiling Point: 239.3°Cat760mmHg
- Flash Point: 107.4°C
- PSA: 63.32
butan-1-amine; octanoic acid Related Literature
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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