tert-Butyl 4-(4-methylbenzoyl)piperidine-1-carboxylate

CAS
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CAS
912768-78-6
Size
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Purity
96%
Price
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Catalog Number

ACM912768786

Product Name

tert-Butyl 4-(4-methylbenzoyl)piperidine-1-carboxylate

Structure

Structure

CAS

912768-78-6

Category

Heterocyclic Organic Compound

Synonyms

TERT-BUTYL 4-(4-METHYLBENZOYL)PIPERIDINE-1-CARBOXYLATE, 912768-78-6, SureCN14113587, AKOS015949320, RP07997, FT-0685032

IUPAC Name

tert-butyl 4-(4-methylbenzoyl)piperidine-1-carboxylate

Molecular Weight

303.4

Molecular Formula

C₁₈H₂₅NO₃

Canonical SMILES

CC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)OC(C)(C)C

InChI Key

MNYKXVMLBQMOEE-UHFFFAOYSA-N

Exact Mass

303.18300

H-Bond Acceptor

3

H-Bond Donor

0

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of tert-Butyl 4-(4-methylbenzoyl)piperidine-1-carboxylate?

The molecular formula is C18H25NO3.

When was tert-Butyl 4-(4-methylbenzoyl)piperidine-1-carboxylate created?

It was created on 2007-12-05.

What is the molecular weight of tert-Butyl 4-(4-methylbenzoyl)piperidine-1-carboxylate?

The molecular weight is 303.4 g/mol.

What are some synonyms for tert-Butyl 4-(4-methylbenzoyl)piperidine-1-carboxylate?

Some synonyms include TERT-BUTYL 4-(4-METHYLBENZOYL)PIPERIDINE-1-CARBOXYLATE, 912768-78-6, MFCD08689345, SCHEMBL14113587, and DTXSID00609138.

What is the InChIKey for tert-Butyl 4-(4-methylbenzoyl)piperidine-1-carboxylate?

The InChIKey is MNYKXVMLBQMOEE-UHFFFAOYSA-N.

How many hydrogen bond acceptor counts does tert-Butyl 4-(4-methylbenzoyl)piperidine-1-carboxylate have?

It has 3 hydrogen bond acceptor counts.

What is the XLogP3-AA value for tert-Butyl 4-(4-methylbenzoyl)piperidine-1-carboxylate?

The XLogP3-AA value is 3.3.

Is tert-Butyl 4-(4-methylbenzoyl)piperidine-1-carboxylate a canonicalized compound?

Yes, it is a canonicalized compound.

How many rotatable bond counts does tert-Butyl 4-(4-methylbenzoyl)piperidine-1-carboxylate have?

It has 4 rotatable bond counts.

What is the topological polar surface area of tert-Butyl 4-(4-methylbenzoyl)piperidine-1-carboxylate?

The topological polar surface area is 46.6 Å2.

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