Cas no 58813-23-3 (L-Histidine, N-butyl-)
L-Histidine, N-butyl- structure
Product Name:L-Histidine, N-butyl-
CAS No:58813-23-3
MF:C10H17N3O2
MW:211.260882139206
CID:340803
PubChem ID:53982024
Update Time:2025-04-19
L-Histidine, N-butyl- Chemical and Physical Properties
Names and Identifiers
-
- L-Histidine, N-butyl-
- (2S)-2-(butylamino)-3-(1H-imidazol-5-yl)propanoic acid
- DTXSID10708141
- 58813-23-3
- N-Butyl-L-histidine
- SCHEMBL3685448
-
- Inchi: 1S/C10H17N3O2/c1-2-3-4-12-9(10(14)15)5-8-6-11-7-13-8/h6-7,9,12H,2-5H2,1H3,(H,11,13)(H,14,15)/t9-/m0/s1
- InChI Key: JYXMNARRSCPLBW-VIFPVBQESA-N
- SMILES: OC([C@H](CC1=CN=CN1)NCCCC)=O
Computed Properties
- Exact Mass: 211.13221
- Monoisotopic Mass: 211.132076794g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 7
- Complexity: 199
- 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: -1.5
- Topological Polar Surface Area: 78?2
Experimental Properties
- PSA: 78.01
L-Histidine, N-butyl- Related Literature
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
-
Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
-
5. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
58813-23-3 (L-Histidine, N-butyl-) Related Products
- 10101-30-1(2-acetamido-3-(1H-imidazol-4-yl)propanoic acid)
- 2497-02-1(N-Acetyl-L-histidine)
- 15191-21-6(N-Formyl-L-histidine)
- 3650-73-5((2S)-2-(4-aminobutanamido)-3-(1H-imidazol-4-yl)propanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
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