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Structure

2-Hydroxyhexyl dihydrogen phosphate

CAS
94134-49-3
Catalog Number
ACM94134493
Category
Other Products
Molecular Weight
198.154061 [g/mol]
Molecular Formula
C6H15O5P

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Specification

Synonyms
2-Hydroxyhexyl dihydrogen phosphate, EINECS 302-818-6, 94134-49-3
IUPAC Name
2-hydroxyhexyl dihydrogen phosphate
Canonical SMILES
CCCCC(COP(=O)(O)O)O
InChI Key
SXDJZSWZEVDTKV-UHFFFAOYSA-N
Boiling Point
365.2ºC at 760mmHg
Flash Point
174.7ºC
Density
1.312g/cm³
EC Number
302-818-6
Exact Mass
198.06600
H-Bond Acceptor
5
H-Bond Donor
3
What is the molecular formula of 2-Hydroxyhexyl dihydrogen phosphate?

The molecular formula of 2-Hydroxyhexyl dihydrogen phosphate is C6H15O5P.

What are some synonyms for 2-Hydroxyhexyl dihydrogen phosphate?

Some synonyms for 2-Hydroxyhexyl dihydrogen phosphate are EINECS 302-818-6, 94134-49-3, SCHEMBL4152528, and DTXSID00916359.

When was 2-Hydroxyhexyl dihydrogen phosphate created and last modified?

2-Hydroxyhexyl dihydrogen phosphate was created on July 11, 2007, and last modified on December 30, 2023.

What is the InChIKey for 2-Hydroxyhexyl dihydrogen phosphate?

The InChIKey for 2-Hydroxyhexyl dihydrogen phosphate is SXDJZSWZEVDTKV-UHFFFAOYSA-N.

What is the exact mass of 2-Hydroxyhexyl dihydrogen phosphate?

The exact mass of 2-Hydroxyhexyl dihydrogen phosphate is 198.06571057 g/mol.

How many hydrogen bond donor counts does 2-Hydroxyhexyl dihydrogen phosphate have?

2-Hydroxyhexyl dihydrogen phosphate has 3 hydrogen bond donor counts.

What is the hydrogen bond acceptor count of 2-Hydroxyhexyl dihydrogen phosphate?

The hydrogen bond acceptor count of 2-Hydroxyhexyl dihydrogen phosphate is 5.

How many rotatable bond counts does 2-Hydroxyhexyl dihydrogen phosphate have?

2-Hydroxyhexyl dihydrogen phosphate has 6 rotatable bond counts.

What is the topological polar surface area of 2-Hydroxyhexyl dihydrogen phosphate?

The topological polar surface area of 2-Hydroxyhexyl dihydrogen phosphate is 87.2.

Is 2-Hydroxyhexyl dihydrogen phosphate a canonicalized compound?

Yes, 2-Hydroxyhexyl dihydrogen phosphate is a canonicalized compound according to PubChem.

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