Basic information
- CAS
1225347-14-7- Standard SMILES
CC(C)(C)OC(=O)NC1(c2ccc3cc(OCc4ccccc4)ccc3c2)COC(C)(C)OC1- InChIKey
FYMQDFOUHONGQB-UHFFFAOYSA-N- Molecular formula
- C28H33NO5
- Average molar mass
- 463.6 g/mol
- Monoisotopic mass
- 463.23587315
Names & identifiers
- Preferred name
- tert-Butyl (5-(6-(benzyloxy)naphthalen-2-yl)-2,2-dimethyl-1,3-dioxan-5-yl)carbamate
- IUPAC
- tert-butyl N-[2,2-dimethyl-5-(6-phenylmethoxynaphthalen-2-yl)-1,3-dioxan-5-yl]carbamate
- English name
- tert-Butyl (5-(6-(benzyloxy)naphthalen-2-yl)-2,2-diMethyl-1,3-dioxan-5-yl)carbaMate
- Molecular formula
- C28H33NO5
- Molecular weight
- 463.57
Names & synonyms
1225347-14-7tert-Butyl (5-(6-(benzyloxy)naphthalen-2-yl)-2,2-dimethyl-1,3-dioxan-5-yl)carbamatetert-butyl N-[2,2-dimethyl-5-(6-phenylmethoxynaphthalen-2-yl)-1,3-dioxan-5-yl]carbamateCarbamic acid, N-[2,2-dimethyl-5-[6-(phenylmethoxy)-2-naphthalenyl]-1,3-dioxan-5-yl]-, 1,1-dimethylethyl esterTERT-BUTYL N-{5-[6-(BENZYLOXY)NAPHTHALEN-2-YL]-2,2-DIMETHYL-1,3-DIOXAN-5-YL}CARBAMATEtert-Butyl {5-[6-(benzyloxy)naphthalen-2-yl]-2,2-dimethyl-1,3-dioxan-5-yl}carbamateFYMQDFOUHONGQB-UHFFFAOYSA-NSCHEMBL2480228DTXSID30737251AKOS015998960tert-butyl 5-(6-(benzyloxy)naphthalen-2-yl)-2,2-dimethyl-1,3-dioxan-5-ylcarbamateDB-327481
Show more names
CarbaMic acid,[5-[(6-benzyloxy-2-naphthalenyl)]-2,2-diMethyl-1,3-dioxan-5-yl]-1,1-diMethyl ethyl ester
tert-Butyl(5-(6-(benzyloxy)naphthalen-2-yl)-2,2-dimethyl-1,3-dioxan-5-yl)carbamate[5-(6-Benzyloxy-naphthalen-2-yl)-2,2-dimethyl-1,3-dioxinan-5-yl]-carbamic acid tert-butyl ester
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 671
Physicochemical properties
- Boiling point
- 608.964 · 608.964±55.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.191 · 1.191±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 10.738 · 10.738±0.40(predicted)
Chemistry & industry
Suppliers2 total
江阴瑞生化学有限公司13003356808 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
Related reactions
3 records
Compound notes
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