CAS
93842-96-7 Purity
96%
93842-96-7 Purity
96%
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1-(3-Cyclohexyl-3-phenyl-2-allyl)pyrrolidine
CAS
93843-00-6
Catalog Number
ACM93843006
Category
Other Products
Molecular Weight
269.424380 [g/mol]
Molecular Formula
C19H27N
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Specification
Synonyms
EINECS 299-077-3, 1-(3-Cyclohexyl-3-phenyl-2-allyl)pyrrolidine, 93843-00-6
IUPAC Name
1-(1-cyclohexyl-1-phenylprop-1-en-2-yl)pyrrolidine
InChI Key
NKXZMDCPHPAUGZ-UHFFFAOYSA-N
Boiling Point
395.6ºC at 760 mmHg
Flash Point
172.7ºC
Density
1.003g/cm³
Exact Mass
269.21400
H-Bond Acceptor
1
H-Bond Donor
0
What is the molecular formula of the compound containing 1-(3-Cyclohexyl-3-phenyl-2-allyl)pyrrolidine?
The molecular formula is C19H27N.
When was the compound created and last modified?
It was created on 2009-08-20 and last modified on 2023-12-30.
What is the IUPAC name of 1-(3-Cyclohexyl-3-phenyl-2-allyl)pyrrolidine?
The IUPAC name is 1-(1-cyclohexyl-1-phenylprop-1-en-2-yl)pyrrolidine.
What is the Canonical SMILES representation of the compound?
The Canonical SMILES representation is CC(=C(C1CCCCC1)C2=CC=CC=C2)N3CCCC3.
What is the InChIKey of 1-(3-Cyclohexyl-3-phenyl-2-allyl)pyrrolidine?
The InChIKey is NKXZMDCPHPAUGZ-UHFFFAOYSA-N.
What is the molecular weight of the compound?
The molecular weight is 269.4 g/mol.
How many hydrogen bond donor counts are there in the compound?
There are 0 hydrogen bond donor counts.
What is the exact mass of the compound?
The exact mass is 269.214349865 g/mol.
How many rotatable bond counts are present in the compound?
There are 3 rotatable bond counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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