CAS
917473-34-8 Purity
96%
917473-34-8 Purity
96%
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2-(P-NITROPHENYL)-1,3-PROPANDIOL
CAS
91748-03-7
Catalog Number
ACM91748037
Category
Other Products
Molecular Weight
197.19
Molecular Formula
C9H11NO4
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Specification
Synonyms
RARECHEM AL BD 1252;2-(P-NITROPHENYL)-1,3-PROPANDIOL
What is the molecular formula of 2-(P-NITROPHENYL)-1,3-PROPANDIOL?
The molecular formula is C9H11NO4.
What is the molecular weight of 2-(P-NITROPHENYL)-1,3-PROPANDIOL?
The molecular weight is 197.19 g/mol.
What is the IUPAC name of 2-(P-NITROPHENYL)-1,3-PROPANDIOL?
The IUPAC name is 2-(4-nitrophenyl)propane-1,3-diol.
What is the InChI of 2-(P-NITROPHENYL)-1,3-PROPANDIOL?
The InChI is InChI=1S/C9H11NO4/c11-5-8(6-12)7-1-3-9(4-2-7)10(13)14/h1-4,8,11-12H,5-6H2.
What is the InChIKey of 2-(P-NITROPHENYL)-1,3-PROPANDIOL?
The InChIKey is LWDKPEXFAQGVTE-UHFFFAOYSA-N.
What is the Canonical SMILES of 2-(P-NITROPHENYL)-1,3-PROPANDIOL?
The Canonical SMILES is C1=CC(=CC=C1C(CO)CO)[N+](=O)[O-].
How many hydrogen bond donor counts does 2-(P-NITROPHENYL)-1,3-PROPANDIOL have?
It has 2 hydrogen bond donor counts.
What is the topological polar surface area of 2-(P-NITROPHENYL)-1,3-PROPANDIOL?
The topological polar surface area is 86.3 Ų.
How many rotatable bond counts does 2-(P-NITROPHENYL)-1,3-PROPANDIOL have?
It has 3 rotatable bond counts.
Is 2-(P-NITROPHENYL)-1,3-PROPANDIOL a canonicalized compound according to PubChem?
Yes, it is a canonicalized compound.
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