Name: Name:2-Adamantyl-1-benzyloxy-4-bromobenzene
Brand: Angene
SKU: AG003GBS
Rating: 90 (10 reviews)

2-Adamantyl-1-benzyloxy-4-bromobenzene

CAS No.:

736992-49-7

Catalog Number:

AG003GBS

Molecular Formula:

C23H25BrO

Molecular Weight:

397.3480

Catalog Number:

AG003GBS

Chemical Name:

2-Adamantyl-1-benzyloxy-4-bromobenzene

CAS Number:

736992-49-7

Molecular Formula:

C23H25BrO

Molecular Weight:

397.3480

MDL Number:

MFCD09258646

IUPAC Name:

2-(5-bromo-2-phenylmethoxyphenyl)adamantane

InChI:

InChI=1S/C23H25BrO/c24-20-6-7-22(25-14-15-4-2-1-3-5-15)21(13-20)23-18-9-16-8-17(11-18)12-19(23)10-16/h1-7,13,16-19,23H,8-12,14H2

InChI Key:

USYFIKGHAJXZFA-UHFFFAOYSA-N

SMILES:

Brc1ccc(c(c1)C1C2CC3CC1CC(C2)C3)OCc1ccccc1

Complexity:

429

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

396.109g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

397.356g/mol

Monoisotopic Mass:

396.109g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

9.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

7.2