CAS
898792-68-2 Purity
96%
898792-68-2 Purity
96%
Inquiry Basket
Ethyl 7-(3-bromophenyl)-7-oxoheptanoate
CAS
898792-71-7
Catalog Number
ACM898792717
Category
Other Products
Molecular Weight
327.21
Molecular Formula
C15H19BrO3
If you have any other questions or need other size, please get a quote.
- Product Description
- Case Study
- Custom Reviews
- Custom Q&A
- Synthetic Use
- Related Resources
Specification
Synonyms
ETHYL 7-(3-BROMOPHENYL)-7-OXOHEPTANOATE
IUPAC Name
ethyl 7-(3-bromophenyl)-7-oxoheptanoate
Canonical SMILES
CCOC(=O)CCCCCC(=O)C1=CC(=CC=C1)Br
InChI Key
QZERDSNBNVRDRH-UHFFFAOYSA-N
Boiling Point
405.5ºC at 760 mmHg
Flash Point
199ºC
Density
1.277g/cm³
Exact Mass
326.05200
H-Bond Acceptor
3
H-Bond Donor
0
What is the IUPAC name of the compound?
ethyl 7-(3-bromophenyl)-7-oxoheptanoate
What is the molecular formula of the compound?
C15H19BrO3
What is the molecular weight of the compound?
327.21 g/mol
What is the InChIKey of the compound?
QZERDSNBNVRDRH-UHFFFAOYSA-N
How many hydrogen bond acceptors does the compound have?
3
What is the value of XLogP3-AA for the compound?
3.7
What is the exact mass of the compound?
326.05176 g/mol
How many rotatable bonds does the compound have?
9
What is the topological polar surface area of the compound?
43.4 Ų
Is the compound canonicalized?
Yes
Recommended Products
