CAS
98855-43-7 Purity
96%
98855-43-7 Purity
96%
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(1R,5R,6R)-3-methylbicyclo[3.1.0]hex-3-ene-6-carbonyl chloride
CAS
98875-01-5
Catalog Number
ACM98875015
Category
Other Products
Molecular Weight
156.60946
Molecular Formula
C8H9ClO
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Specification
Synonyms
CID179140, (1R,5S,6R)-3-methylbicyclo[3.1.0]hex-3-ene-6-carbonyl Chloride, 98875-01-5
IUPAC Name
(1S,5S,6R)-3-methylbicyclo[3.1.0]hex-3-ene-6-carbonyl chloride
Canonical SMILES
CC1=CC2C(C1)C2C(=O)Cl
InChI Key
MKFVRCBLWIBNLD-VQVTYTSYSA-N
Density
1.254g/cm³
Exact Mass
156.03400
H-Bond Acceptor
1
H-Bond Donor
0
What is the molecular formula of the compound?
The molecular formula of the compound is C8H9ClO.
What is the molecular weight of the compound?
The molecular weight of the compound is 156.61 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is (1R,5R,6R)-3-methylbicyclo[3.1.0]hex-2-ene-6-carbonyl chloride.
What is the InChIKey of the compound?
The InChIKey of the compound is MKFVRCBLWIBNLD-XVMARJQXSA-N.
How many hydrogen bond donor counts does the compound have?
The compound has 0 hydrogen bond donor counts.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value of the compound is 1.6.
What is the exact mass of the compound?
The exact mass of the compound is 156.0341926 g/mol.
How many defined atom stereocenter counts does the compound have?
The compound has 3 defined atom stereocenter counts.
Does the compound have any undefined bond stereocenter counts?
No, the compound does not have any undefined bond stereocenter counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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CAS
98877-82-8 Purity
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98877-82-8 Purity
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