CAS
93840-85-8 Purity
96%
93840-85-8 Purity
96%
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6-(4-Methyl-3-cyclohexen-1-yl)hept-4-enal
CAS
93840-88-1
Catalog Number
ACM93840881
Category
Other Products
Molecular Weight
206.323880 [g/mol]
Molecular Formula
C14H22O
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Specification
Synonyms
EINECS 298-955-3, CID6366261, 6-(4-Methyl-3-cyclohexen-1-yl)hept-4-enal, 93840-88-1
IUPAC Name
(E)-6-(4-methylcyclohex-3-en-1-yl)hept-4-enal
Canonical SMILES
CC1=CCC(CC1)C(C)C=CCCC=O
InChI Key
MAFITFSDTGHHDL-GQCTYLIASA-N
Boiling Point
294.2ºC at 760mmHg
Flash Point
135.7ºC
Density
0.909g/cm³
EC Number
298-955-3
Exact Mass
206.16700
H-Bond Acceptor
1
H-Bond Donor
0
What is the molecular formula of the compound?
The molecular formula of the compound is C14H22O.
What is the molecular weight of the compound?
The molecular weight of the compound is 206.32 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is (E)-6-(4-methylcyclohex-3-en-1-yl)hept-4-enal.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C14H22O/c1-12-7-9-14(10-8-12)13(2)6-4-3-5-11-15/h4,6-7,11,13-14H,3,5,8-10H2,1-2H3/b6-4+.
What is the InChIKey of the compound?
The InChIKey of the compound is MAFITFSDTGHHDL-GQCTYLIASA-N.
What is the canonical SMILES of the compound?
The canonical SMILES of the compound is CC1=CCC(CC1)C(C)C=CCCC=O.
What is the isomeric SMILES of the compound?
The isomeric SMILES of the compound is CC1=CCC(CC1)C(C)/C=C/CCC=O.
What is the CAS number of the compound?
The CAS number of the compound is 93840-88-1.
What is the EC number of the compound?
The EC number of the compound is 298-955-3.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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CAS
93840-87-0 Purity
96%
93840-87-0 Purity
96%
