Basic information
- CAS
1219794-56-5- Standard SMILES
[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])c1ccc(OC)cc1- InChIKey
RGDZNCUQBISCLM-RORPREDISA-N- Molecular formula
- C15H24O
- Average molar mass
- 237.45 g/mol
Names & identifiers
- Preferred name
- 4-N-Octyl-D17-anisole
- IUPAC
- 1-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecadeuteriooctyl)-4-methoxybenzene
- English name
- 4-n-Octyl-d17-anisole
- Molecular formula
- C15H7D17O
- Molecular weight
- 237.46
Names & synonyms
4-N-OCTYL-D17-ANISOLE1219794-56-54-n-Octyl-anisole-d17HY-151186SDA-49746CS-0608267D984251-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecadeuteriooctyl)-4-methoxy-benzene1-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecadeuteriooctyl)-4-methoxybenzene
Database identifiers
- CAS
1219794-56-5
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 8
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 148
Chemistry & industry
Applications
Uses4-n-Octyl-d17-anisole (CAS# 1219794-56-5) is a useful isotopically labeled research compound.
Suppliers4 total
盐城通铭生物科技有限公司15195160625 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
成都思天德生物科技有限公司028-83243028 19136088901 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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