CAS
940284-55-9 Purity
---
940284-55-9 Purity
---
Inquiry Basket
2,2-Bis-(bromomethyl)propane-1,3-diyl tetrahydrogen bisphosphate
CAS
94030-76-9
Catalog Number
ACM94030769
Category
Other Products
Molecular Weight
421.899504 [g/mol]
Molecular Formula
C5H12Br2O8P2
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
EINECS 301-682-5, 2,2-Bis(bromomethyl)propane-1,3-diyl tetrahydrogen bisphosphate, 94030-76-9
IUPAC Name
[2,2-bis(bromomethyl)-3-phosphonooxypropyl] dihydrogen phosphate
Canonical SMILES
C(C(COP(=O)(O)O)(CBr)CBr)OP(=O)(O)O
InChI Key
CSEOIVTVQILBPP-UHFFFAOYSA-N
EC Number
301-682-5
Exact Mass
419.83700
H-Bond Acceptor
8
H-Bond Donor
4
What is the IUPAC name of the compound?
The IUPAC name of the compound is [2,2-bis(bromomethyl)-3-phosphonooxypropyl] dihydrogen phosphate.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C5H12Br2O8P2/c6-1-5(2-7,3-14-16(8,9)10)4-15-17(11,12)13/h1-4H2,(H2,8,9,10)(H2,11,12,13).
What is the InChIKey of the compound?
The InChIKey of the compound is CSEOIVTVQILBPP-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES of the compound is C(C(COP(=O)(O)O)(CBr)CBr)OP(=O)(O)O.
What is the molecular formula of the compound?
The molecular formula of the compound is C5H12Br2O8P2.
What is the molecular weight of the compound?
The molecular weight of the compound is 421.90 g/mol.
What is the CAS number of the compound?
The CAS number of the compound is 94030-76-9.
What is the EC number of the compound?
The EC number of the compound is 301-682-5.
What is the DSSTox Substance ID of the compound?
The DSSTox Substance ID of the compound is DTXSID90240332.
Is the compound canonicalized?
Yes, the compound is canonicalized.
Recommended Products
![Methyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-3-carboxylate](https://resource.alfa-chemistry.com/structure/940284-55-9.gif)
CAS
94030-74-7 Purity
96%
94030-74-7 Purity
96%
CAS
94030-83-8 Purity
96%
94030-83-8 Purity
96%
