CAS
955314-95-1 Purity
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955314-95-1 Purity
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4-Piperidin-3-ylmethyl-phenol
CAS
955315-07-8
Catalog Number
ACM955315078
Category
Other Products
Molecular Weight
191.27
Molecular Formula
C12H17NO
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Specification
Synonyms
4-Piperidin-3-ylmethyl-phenol, 955315-07-8, AGN-PC-01A9CH, SureCN9748441, 4-piperidin-3-ylmethylphenol, 4-(piperidin-3-ylmethyl)phenol, CTK5H7821, 4-(3-PIPERIDINYLMETHYL)PHENOL, AKOS006283485, AB22614, AG-H-93004, KB-243084
IUPAC Name
4-(piperidin-3-ylmethyl)phenol
Canonical SMILES
C1CC(CNC1)CC2=CC=C(C=C2)O
InChI Key
VJHMLHKDZVTNDZ-UHFFFAOYSA-N
Boiling Point
333.8ºC at 760 mmHg
Flash Point
132.3ºC
Density
1.067g/cm³
Exact Mass
191.13100
H-Bond Acceptor
2
H-Bond Donor
2
What is the molecular formula of the compound?
The molecular formula of the compound is C12H17NO.
What is the molecular weight of the compound?
The molecular weight of the compound is 191.27 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is 4-(piperidin-3-ylmethyl)phenol.
What is the InChIKey of the compound?
The InChIKey of the compound is VJHMLHKDZVTNDZ-UHFFFAOYSA-N.
How many hydrogen bond donor counts does the compound have?
The compound has 2 hydrogen bond donor counts.
What is the exact mass of the compound?
The exact mass of the compound is 191.131014166 g/mol.
How many heavy atoms are present in the compound?
The compound has 14 heavy atoms.
Does the compound have any defined atom stereocenter count?
No, the compound does not have any defined atom stereocenter count.
What is the topological polar surface area of the compound?
The topological polar surface area of the compound is 32.3 Ų.
Is the compound canonicalized?
Yes, the compound is canonicalized according to PubChem.
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