Cyclohexanepropanoicacid,a-[[(1,1-dimethylethoxy)carbonyl]amino]-,methyl ester,(as)-

CAS

98105-41-0

Catalog Number

ACM98105410

Category

Other Products

Molecular Weight

285.38

Molecular Formula

C₁₅H₂₇NO₄

MSDS COA Spec Sheet

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Specification

Synonyms

Boc-Cha-OMe, Boc-3-cyclohexyl-L-alanine methyl ester, N-(tert-Butoxycarbonyl)-3-cyclohexyl-L-alanine methyl ester, SureCN5063217, 421715_ALDRICH, 15088_FLUKA, ZINC02556723, 98105-41-0

IUPAC Name

methyl (2S)-3-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

InChI Key

FALUXMVPGFKLAM-LBPRGKRZSA-N

Melting Point

47-49 â„ƒ(lit.)

Exact Mass

285.19400

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of Cyclohexanepropanoicacid?

The molecular formula of Cyclohexanepropanoicacid is C15H27NO4.

What is the molecular weight of Cyclohexanepropanoicacid?

The molecular weight of Cyclohexanepropanoicacid is 285.38 g/mol.

What is the IUPAC name of Cyclohexanepropanoicacid?

The IUPAC name of Cyclohexanepropanoicacid is methyl (2S)-3-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate.

What is the InChI of Cyclohexanepropanoicacid?

The InChI of Cyclohexanepropanoicacid is InChI=1S/C15H27NO4/c1-15(2,3)20-14(18)16-12(13(17)19-4)10-11-8-6-5-7-9-11/h11-12H,5-10H2,1-4H3,(H,16,18)/t12-/m0/s1.

What is the InChIKey of Cyclohexanepropanoicacid?

The InChIKey of Cyclohexanepropanoicacid is FALUXMVPGFKLAM-LBPRGKRZSA-N.

What is the canonical SMILES of Cyclohexanepropanoicacid?

The canonical SMILES of Cyclohexanepropanoicacid is CC(C)(C)OC(=O)NC(CC1CCCCC1)C(=O)OC.

What is the isomeric SMILES of Cyclohexanepropanoicacid?

The isomeric SMILES of Cyclohexanepropanoicacid is CC(C)(C)OC(=O)N[C@@H](CC1CCCCC1)C(=O)OC.

What is the CAS number of Cyclohexanepropanoicacid?

The CAS number of Cyclohexanepropanoicacid is 98105-41-0.

What is the XLogP3-AA value of Cyclohexanepropanoicacid?

The XLogP3-AA value of Cyclohexanepropanoicacid is 4.

Is Cyclohexanepropanoicacid a canonicalized compound?

Yes, Cyclohexanepropanoicacid is a canonicalized compound.