Cas no 56472-43-6 (9-Octadecenoic acid,2-amino-, (9Z)-)
56472-43-6 structure
Product Name:9-Octadecenoic acid,2-amino-, (9Z)-
CAS No:56472-43-6
MF:C18H35NO2
MW:297.476005792618
CID:370308
PubChem ID:6441701
Update Time:2025-04-19
9-Octadecenoic acid,2-amino-, (9Z)- Chemical and Physical Properties
Names and Identifiers
-
- 9-Octadecenoic acid,2-amino-, (9Z)-
- 2-(amino)oleic acid
- 2-aminooctadec-9-enoic acid
- (9Z)-2-Aminooctadec-9-enoic acid
- 2-Amino oleic acid
- SCHEMBL746572
- 2-AOA
- alpha-Aminooleic acid
- 56472-43-6
- (Z)-2-Amino-9-octadecanoic acid
- 9-Octadecanoic acid, 2-amino-, (Z)-
- alpha-amino-oleic acid
-
- Inchi： 1S/C18H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(19)18(20)21/h9-10,17H,2-8,11-16,19H2,1H3,(H,20,21)/b10-9-
- InChI Key： ODURFHDFZAVGHC-KTKRTIGZSA-N
- SMILES： OC(C(CCCCCC/C=C\CCCCCCCC)N)=O
Computed Properties
- Exact Mass: 297.26695
- Monoisotopic Mass: 297.266779359g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 15
- Complexity: 264
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4
- Topological Polar Surface Area: 63.3?2
Experimental Properties
- PSA: 63.32
9-Octadecenoic acid,2-amino-, (9Z)- Related Literature
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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