5-Bromo-2-adamantanone

HCID 590905
NotesReactions
Substructure searchFind similar structures

Basic information

CAS
20098-20-8
Standard SMILES
O=C1C2CC3CC1CC(Br)(C3)C2
InChIKey
TXEWIOREYPSNRR-UHFFFAOYSA-N
Molecular formula
C10H13BrO
Average molar mass
229.11 g/mol
Monoisotopic mass
228.01497714

Names & identifiers

Preferred name
5-Bromo-2-adamantanone
IUPAC
5-bromoadamantan-2-one
English name
5-Bromo-2-adamantanone
Molecular formula
C10H13BrO
Molecular weight
229.11

Names & synonyms

5-Bromo-2-adamantanone20098-20-8DTXSID80343609RefChem:1072710DTXCID802946875-Bromoadamantan-2-oneTricyclo[3.3.1.13,7]decan-2-one, 5-bromo-5-bromo-2-oxoadamantane5-Bromo-2-adamantanone #AKOS0168442785-bromo-2-adamantoneCS-0449415
Show more names
5-BROMO-2-ADAMANTANONE55-Bromo-2-adamantanone >5-Bromo-2-adamantanone,≥98%5-BROMO-2-ADAMANTANONE,98.0%(GC)5-Bromotricyclo[3.3.1.13,7]decanone5-bromotricyclo[3.3.1.1~3,7~]decan-2-one1-Bromoadamantan-4-one, 5-Bromotricyclo[3.3.1.13,7]decanone
MFCD013210971-Bromoadamantan-4-one4-(3-Chlorophenoxy)bFT-0715864A814240SCHEMBL4368426AKOS004120777FB66468

Database identifiers

CAS
20098-20-8
PubChem CID
590905
DTXSID
DTXSID80343609

Properties

Computed structural properties

XLogP
2
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
12

Physicochemical properties

Melting point
153 °C · 153 °C
storage temp.
Store at room temperature
form
powder to crystal
color
White to Light yellow
WGK Germany
3 · 3
HS Code
2914.29 · 2914.29.5000

Safety & regulation

Safety data

wgk
3
hs_code
2914.29.5000

Chemistry & industry

Upstream & downstream products

Downstream products

Suppliers45 total

上海康恩博医药科技有限公司17510465506 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

Loading…