Cas no 37689-89-7 ((S)-2,7-diaminoheptanoic acid)
(S)-2,7-diaminoheptanoic acid structure
Product Name:(S)-2,7-diaminoheptanoic acid
CAS No:37689-89-7
MF:C7H16N2O2
MW:160.214141845703
CID:922510
PubChem ID:11051955
Update Time:2025-04-19
(S)-2,7-diaminoheptanoic acid Chemical and Physical Properties
Names and Identifiers
-
- (S)-2,7-diaminoheptanoic acid
- 2,7-diaminoheptanoic acid
- DB-258180
- AKOS027323729
- MFCD18968895
- AT25880
- Homolysine*
- EINECS 253-630-5
- NMDDZEVVQDPECF-LURJTMIESA-N
- DTXSID20958731
- SCHEMBL2267477
- CHEBI:194377
- 37689-89-7
- NS00058008
- (2S)-2,7-DIAMINOHEPTANOIC ACID
-
- Inchi： 1S/C7H16N2O2/c8-5-3-1-2-4-6(9)7(10)11/h6H,1-5,8-9H2,(H,10,11)/t6-/m0/s1
- InChI Key： NMDDZEVVQDPECF-LURJTMIESA-N
- SMILES： OC([C@H](CCCCCN)N)=O
Computed Properties
- Exact Mass: 160.12128
- Monoisotopic Mass: 160.121177757g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 6
- Complexity: 117
- 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: -2.7
- Topological Polar Surface Area: 89.3?2
Experimental Properties
- PSA: 89.34
(S)-2,7-diaminoheptanoic acid Related Literature
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
-
Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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