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L-Aspartic acid,N-dodecyl-,4-dodecyl ester

CAS
94788-91-7
Catalog Number
ACM94788917
Category
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What is the molecular formula of L-Aspartic acid, N-dodecyl-, 4-dodecyl ester?

The molecular formula is C28H55NO4.

What is the PubChem CID of L-Aspartic acid, N-dodecyl-, 4-dodecyl ester?

The PubChem CID is 90477746.

What is the IUPAC name of L-Aspartic acid, N-dodecyl-, 4-dodecyl ester?

The IUPAC name is (3S)-4-dodecan-4-yloxy-3-(dodecylamino)-4-oxobutanoic acid.

What is the InChI of L-Aspartic acid, N-dodecyl-, 4-dodecyl ester?

The InChI is InChI=1S/C28H55NO4/c1-4-7-9-11-13-14-15-16-18-20-23-29-26(24-27(30)31)28(32)33-25(21-6-3)22-19-17-12-10-8-5-2/h25-26,29H,4-24H2,1-3H3,(H,30,31)/t25?,26-/m0/s1.

What is the InChIKey of L-Aspartic acid, N-dodecyl-, 4-dodecyl ester?

The InChIKey is SOMAYYFAESXLCM-AMVUTOCUSA-N.

What is the Canonical SMILES of L-Aspartic acid, N-dodecyl-, 4-dodecyl ester?

The Canonical SMILES is CCCCCCCCCCCCNC(CC(=O)O)C(=O)OC(CCC)CCCCCCCC.

What is the molecular weight of L-Aspartic acid, N-dodecyl-, 4-dodecyl ester?

The molecular weight is 469.7 g/mol.

What is the XLogP3-AA value of L-Aspartic acid, N-dodecyl-, 4-dodecyl ester?

The XLogP3-AA value is 7.8.

How many hydrogen bond donor counts does L-Aspartic acid, N-dodecyl-, 4-dodecyl ester have?

It has 2 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does L-Aspartic acid, N-dodecyl-, 4-dodecyl ester have?

It has 5 hydrogen bond acceptor counts.

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