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Structure

3-(3-Hydroxypropoxy)propyl laurate

CAS
97635-32-0
Catalog Number
ACM97635320
Category
Other Products
Molecular Weight
316.476040 [g/mol]
Molecular Formula
C18H36O4

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Specification

Synonyms
3-(3-Hydroxypropoxy)propyl laurate, EINECS 307-394-6, CID3024984, 97635-32-0
IUPAC Name
3-(3-hydroxypropoxy)propyl dodecanoate
Canonical SMILES
CCCCCCCCCCCC(=O)OCCCOCCCO
InChI Key
CGGKBZSXQOLUNV-UHFFFAOYSA-N
Boiling Point
422.2ºC at 760 mmHg
Flash Point
137.1ºC
Density
0.95g/cm³
EC Number
307-394-6
Exact Mass
316.26100
H-Bond Acceptor
4
H-Bond Donor
1
What is the molecular formula of 3-(3-Hydroxypropoxy)propyl laurate?

The molecular formula is C18H36O4.

What is the molecular weight of 3-(3-Hydroxypropoxy)propyl laurate?

The molecular weight is 316.5 g/mol.

What is the IUPAC name of 3-(3-Hydroxypropoxy)propyl laurate?

The IUPAC name is 3-(3-hydroxypropoxy)propyl dodecanoate.

What is the InChI of 3-(3-Hydroxypropoxy)propyl laurate?

The InChI is InChI=1S/C18H36O4/c1-2-3-4-5-6-7-8-9-10-13-18(20)22-17-12-16-21-15-11-14-19/h19H,2-17H2,1H3.

What is the InChIKey of 3-(3-Hydroxypropoxy)propyl laurate?

The InChIKey is CGGKBZSXQOLUNV-UHFFFAOYSA-N.

What is the Canonical SMILES of 3-(3-Hydroxypropoxy)propyl laurate?

The Canonical SMILES is CCCCCCCCCCCC(=O)OCCCOCCCO.

What is the CAS number of 3-(3-Hydroxypropoxy)propyl laurate?

The CAS number is 97635-32-0.

What is the XLogP3-AA value of 3-(3-Hydroxypropoxy)propyl laurate?

The XLogP3-AA value is 5.2.

How many hydrogen bond donor counts are in 3-(3-Hydroxypropoxy)propyl laurate?

There is 1 hydrogen bond donor count.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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