CAS
94237-09-9 Purity
96%
94237-09-9 Purity
96%
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1-(4-Nonylphenoxy)propan-2-ol
CAS
94237-15-7
Catalog Number
ACM94237157
Category
Other Products
Molecular Weight
278.429600 [g/mol]
Molecular Formula
C18H30O2
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Specification
Synonyms
1-(4-Nonylphenoxy)propan-2-ol, 94237-15-7, EINECS 304-114-4, AC1MIFTH, SureCN547162, CTK5H6016, AG-H-88744, KB-215181
IUPAC Name
1-(4-nonylphenoxy)propan-2-ol
SMILES
CCCCCCCCCC1=CC=C(C=C1)OCC(C)O
InChI Key
WLCXMYXZQNWTKN-UHFFFAOYSA-N
Boiling Point
394.6ºC at 760 mmHg
Flash Point
157.6ºC
Density
0.951g/cm³
EC Number
304-114-4
Exact Mass
278.22500
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of 1-(4-Nonylphenoxy)propan-2-ol?
The molecular formula is C18H30O2.
What is the molecular weight of 1-(4-Nonylphenoxy)propan-2-ol?
The molecular weight is 278.4 g/mol.
What is the IUPAC Name of 1-(4-Nonylphenoxy)propan-2-ol?
The IUPAC Name is 1-(4-nonylphenoxy)propan-2-ol.
What is the Canonical SMILES of 1-(4-Nonylphenoxy)propan-2-ol?
The Canonical SMILES is CCCCCCCCCC1=CC=C(C=C1)OCC(C)O.
What is the InChI of 1-(4-Nonylphenoxy)propan-2-ol?
The InChI is InChI=1S/C18H30O2/c1-3-4-5-6-7-8-9-10-17-11-13-18(14-12-17)20-15-16(2)19/h11-14,16,19H,3-10,15H2,1-2H3
What is the InChIKey of 1-(4-Nonylphenoxy)propan-2-ol?
The InChIKey is WLCXMYXZQNWTKN-UHFFFAOYSA-N.
How many Hydrogen Bond Donor Count does 1-(4-Nonylphenoxy)propan-2-ol have?
It has 1 Hydrogen Bond Donor Count.
What is the XLogP3-AA value of 1-(4-Nonylphenoxy)propan-2-ol?
The XLogP3-AA value is 6.2.
How many Rotatable Bond Count does 1-(4-Nonylphenoxy)propan-2-ol have?
It has 11 Rotatable Bond Count.
Is 1-(4-Nonylphenoxy)propan-2-ol a canonicalized compound?
Yes, it is a canonicalized compound.
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