Boc-Ser(Bzl)-OH DCHA supplier

Name
Boc-Ser(Bzl)-OH DCHA
EINECS 233-741-5
CAS No. 10342-01-5
Density
Solubility
Melting Point
Formula C₂₇H₄₄N₂O₅
Boiling Point 624.7 °C at 760 mmHg
Molecular Weight 476.6487
Flash Point 331.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Boc-Ser(Bzl)-OH?DCHA;O-Benzyl-N-(tert-butoxycarbonyl)-L-serine, compound with dicyclohexylamine (1:1);
PSA 96.89000
LogP 6.20430

Boc-Ser(Bzl)-OH DCHA Specification

The Boc-Ser(Bzl)-OH DCHA is an organic compound with the formula C₂₇H₄₄N₂O₅. The IUPAC name of this chemical is N-cyclohexylcyclohexanamine; (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxypropanoic acid. With the CAS registry number 10342-01-5, it is also named as O-Benzyl-N-(tert-butoxycarbonyl)-L-serine - N-cyclohexylcyclohexanamine (1:1).

Physical properties about Boc-Ser(Bzl)-OH DCHA are: (1)ACD/LogP: 7.25; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 4.75; (4)ACD/LogD (pH 7.4): 4.75 ; (5)#H bond acceptors: 7; (6)#H bond donors: 3; (7)#Freely Rotating Bonds: 10; (8)Polar Surface Area: 96.89 Å²; (9)Flash Point: 331.6 °C; (10)Enthalpy of Vaporization: 97.23 kJ/mol; (11)Boiling Point: 624.7 °C at 760 mmHg; (12)Vapour Pressure: 1.81E-16 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)[C@@H](NC(=O)OC(C)(C)C)COCc1ccccc1.C1CCCCC1NC2CCCCC2
(2)InChI: InChI=1/C15H21NO5.C12H23N/c1-15(2,3)21-14(19)16-12(13(17)18)10-20-9-11-7-5-4-6-8-11;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h4-8,12H,9-10H2,1-3H3,(H,16,19)(H,17,18);11-13H,1-10H2/t12-;/m0./s1
(3)InChIKey: QAAQPSNBIGNDII-YDALLXLXBR
(4)Std. InChI: InChI=1S/C15H21NO5.C12H23N/c1-15(2,3)21-14(19)16-12(13(17)18)10-20-9-11-7-5-4-6-8-11;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h4-8,12H,9-10H2,1-3H3,(H,16,19)(H,17,18);11-13H,1-10H2/t12-;/m0./s1
(5)Std. InChIKey: QAAQPSNBIGNDII-YDALLXLXSA-N

Product Name

Boc-Ser(Bzl)-OH DCHA

Boc-Ser(Bzl)-OH DCHA Specification

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