Cas no 93955-16-9 (Benzeneethanamine,3-amino-a-methyl-, (S)- (9CI))
93955-16-9 structure
Product Name:Benzeneethanamine,3-amino-a-methyl-, (S)- (9CI)
CAS No:93955-16-9
MF:C9H14N2
MW:150.220861911774
CID:797520
PubChem ID:22828073
Update Time:2025-04-19
Benzeneethanamine,3-amino-a-methyl-, (S)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Benzeneethanamine,3-amino-a-methyl-, (S)- (9CI)
- Benzeneethanamine, 3-amino-alpha-methyl-, (S)- (9CI)
- 3-[(2S)-2-Aminopropyl]aniline
- SCHEMBL11059954
- DTXSID50628450
- 93955-16-9
- AKOS027419500
-
- Inchi: 1S/C9H14N2/c1-7(10)5-8-3-2-4-9(11)6-8/h2-4,6-7H,5,10-11H2,1H3/t7-/m0/s1
- InChI Key: SZSWEYKUELOAGN-ZETCQYMHSA-N
- SMILES: N[C@@H](C)CC1C=CC=C(C=1)N
Computed Properties
- Exact Mass: 150.115698455g/mol
- Monoisotopic Mass: 150.115698455g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 114
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.8
- Topological Polar Surface Area: 52?2
Benzeneethanamine,3-amino-a-methyl-, (S)- (9CI) Related Literature
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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