CAS
97055-09-9 Purity
96%
97055-09-9 Purity
96%
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4-Methylumbelliferyl phosphocholine
CAS
97055-84-0
Catalog Number
ACM97055840
Category
Other Products
Molecular Weight
341.26
Molecular Formula
C15H20NO6P
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Specification
Synonyms
4-Mupc, 4-Methylumbelliferyl phosphorylcholine, CID126160, ZINC06069643, ZINC22064122, 97055-84-0
IUPAC Name
(4-methyl-2-oxochromen-7-yl) 2-(trimethylazaniumyl)ethyl phosphate
Canonical SMILES
CC1=CC(=O)OC2=C1C=CC(=C2)OP(=O)([O-])OCC[N+](C)(C)C
InChI Key
XFDMHBWTKCGCSD-UHFFFAOYSA-N
Melting Point
268-271ºC
Appearance
White Crystalline Solid
Exact Mass
341.10300
H-Bond Acceptor
6
H-Bond Donor
0
What is the molecular formula of 4-Methylumbelliferyl phosphocholine?
The molecular formula of 4-Methylumbelliferyl phosphocholine is C15H20NO6P.
What is the molecular weight of 4-Methylumbelliferyl phosphocholine?
The molecular weight of 4-Methylumbelliferyl phosphocholine is 341.30 g/mol.
What are some synonyms for 4-Methylumbelliferyl phosphocholine?
Some synonyms for 4-Methylumbelliferyl phosphocholine include 4-Methylumbelliferyl Phosphocholine, 4-Mupc, and 4-Methyl-2-oxo-2H-chromen-7-yl.
When was 4-Methylumbelliferyl phosphocholine first created?
4-Methylumbelliferyl phosphocholine was first created on August 8, 2005.
What is the InChIKey for 4-Methylumbelliferyl phosphocholine?
The InChIKey for 4-Methylumbelliferyl phosphocholine is XFDMHBWTKCGCSD-UHFFFAOYSA-N.
What is the XLogP3 value for 4-Methylumbelliferyl phosphocholine?
The XLogP3 value for 4-Methylumbelliferyl phosphocholine is 1.1.
How many hydrogen bond donor counts are there in 4-Methylumbelliferyl phosphocholine?
There are 0 hydrogen bond donor counts in 4-Methylumbelliferyl phosphocholine.
What is the topological polar surface area of 4-Methylumbelliferyl phosphocholine?
The topological polar surface area of 4-Methylumbelliferyl phosphocholine is 84.9 Ų.
How many rotatable bond counts are there in 4-Methylumbelliferyl phosphocholine?
There are 6 rotatable bond counts in 4-Methylumbelliferyl phosphocholine.
Is the compound canonicalized for 4-Methylumbelliferyl phosphocholine?
Yes, the compound is canonicalized for 4-Methylumbelliferyl phosphocholine.
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