1-(Butoxymethyl)-3-octadecylurea

Name: 1-(Butoxymethyl)-3-octadecylurea
SKU: ACM94277846
Rating: 5 (1 reviews)

CAS

94277-84-6

Catalog Number

ACM94277846

Category

Other Products

Molecular Weight

398.666000 [g/mol]

Molecular Formula

C₂₄H₅₀N₂O₂

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Specification

Synonyms

1-(Butoxymethyl)-3-octadecylurea, 94277-84-6, EINECS 304-668-7, AC1MIG1B, CTK5H6216, AG-H-89163

IUPAC Name

1-(butoxymethyl)-3-octadecylurea

Canonical SMILES

CCCCCCCCCCCCCCCCCCNC(=O)NCOCCCC

InChI Key

HWSGWVHMCJKESQ-UHFFFAOYSA-N

Boiling Point

524.3ºC at 760mmHg

Flash Point

270.9ºC

Density

0.894g/cm³

EC Number

304-668-7

Exact Mass

398.38700

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of the compound 1-(Butoxymethyl)-3-octadecylurea?

The molecular formula is C24H50N2O2.

When was the compound first created?

The compound was created on August 8, 2005.

What is the molecular weight of 1-(Butoxymethyl)-3-octadecylurea?

The molecular weight is 398.7 g/mol.

What is the synonym for 1-(Butoxymethyl)-3-octadecylurea?

One of the synonyms is 94277-84-6.

What is the InChIKey for the compound?

The InChIKey is HWSGWVHMCJKESQ-UHFFFAOYSA-N.

How many hydrogen bond donor counts are there in 1-(Butoxymethyl)-3-octadecylurea?

There are 2 hydrogen bond donor counts.

What is the XLogP3-AA value for the compound?

The XLogP3-AA value is 9.4.

How many rotatable bond counts are there in 1-(Butoxymethyl)-3-octadecylurea?

There are 22 rotatable bond counts.

What is the topological polar surface area of the compound?

The topological polar surface area is 50.4 Å².

Is the compound canonicalized?

Yes, the compound is canonicalized.

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