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Name |
D-Tryptophan,N-[(1,1-dimethylethoxy)carbonyl]-1-formyl- |
EINECS | N/A |
CAS No. | 64905-10-8 | Density | 1.26g/cm3 |
PSA | 97.63000 | LogP | 3.19300 |
Solubility | N/A | Melting Point |
N/A |
Formula | C17H20N2O5 | Boiling Point | N/A |
Molecular Weight | 332.356 | Flash Point | N/A |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Boc-D-Trp(For)-OH; |
The D-Tryptophan,N-[(1,1-dimethylethoxy)carbonyl]-1-formyl-, with CAS registry number 64905-10-8, belongs to the following product categories: (1)Amino Acids; (2)Boc-Amino Acids and Derivative. It has the systematic name of N-(tert-butoxycarbonyl)-1-formyl-L-tryptophan. This chemical should be stored at the temperature of 2-8°C.
Physical properties of D-Tryptophan,N-[(1,1-dimethylethoxy)carbonyl]-1-formyl-: (1)ACD/LogP: 3.06; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.94; (4)ACD/LogD (pH 7.4): -0.51; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 8.42; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 7; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 77.84 Å2; (13)Index of Refraction: 1.58; (14)Molar Refractivity: 87.57 cm3; (15)Molar Volume: 263.1 cm3; (16)Polarizability: 34.71×10-24cm3; (17)Surface Tension: 47 dyne/cm.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc2c1ccccc1n(c2)C=O
(2)InChI: InChI=1/C17H20N2O5/c1-17(2,3)24-16(23)18-13(15(21)22)8-11-9-19(10-20)14-7-5-4-6-12(11)14/h4-7,9-10,13H,8H2,1-3H3,(H,18,23)(H,21,22)/t13-/m0/s1
(3)InChIKey: IHXHBYFWSOYYTR-ZDUSSCGKBJ
(4)Std. InChI: InChI=1S/C17H20N2O5/c1-17(2,3)24-16(23)18-13(15(21)22)8-11-9-19(10-20)14-7-5-4-6-12(11)14/h4-7,9-10,13H,8H2,1-3H3,(H,18,23)(H,21,22)/t13-/m0/s1
(5)Std. InChIKey: IHXHBYFWSOYYTR-ZDUSSCGKSA-N