| CAS Number | 149966-28-9 |
| Catalog Number | AG00AX4Y(AGN-PC-00EF3P) |
| Chemical Name | 1-[(2-bromoethoxy)methyl]-4-methoxybenzene |
| IUPAC Name | 1-(2-bromoethoxymethyl)-4-methoxybenzene |
| InChI | InChI=1S/C10H13BrO2/c1-12-10-4-2-9(3-5-10)8-13-7-6-11/h2-5H,6-8H2,1H3 |
| InChI Key | XDLFIODZEMIBRY-UHFFFAOYSA-N |
| MDL Number | MFCD11147560 |
| Molecular Formula | C10H13BrO2 |
| Molecular Weight | 245.1130 |
| SMILES | COC1=CC=C(C=C1)COCCBr |
| Synonyms | 149966-28-9,
1-[(2-bromoethoxy)methyl]-4-methoxybenzene,
1-[(2-Bromoethoxy)methyl]-4-methoxy-benzene,
1-(2-Bromoethoxymethyl)-4-methoxybenzene,
AC1Q4CU5,
Benzene, 1-[(2-bromoethoxy)methyl]-4-methoxy-,
SCHEMBL1427941,
XDLFIODZEMIBRY-UHFFFAOYSA-N,
2-(4-Methoxybenzyloxy)bromoethane,
4-Methoxybenzyl(2-bromoethyl) ether,
ZINC19965643,
AKOS000246929,
NE58148,
1-(2-bromo-ethoxymethyl)-4-methoxy-benzene,
1-(2-bromo-ethoxymethyl)-4-methoxy -benzene,
EN300-72712,
I01-8996,
CID11701510,
1-(2-bromoethoxymethyl)-4-methoxy-benzene,
|
| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 245.116g/mol |
| Monoisotopic Mass | 244.01g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number