Tricyclo(3.3.1.13,7)decane-1-carboxamide

HCID 21686
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Substructure searchFind similar structures

Basic information

CAS
5511-18-2
Standard SMILES
NC(=O)C12CC3CC(CC(C3)C1)C2
InChIKey
CKBZJTAMRPPVSR-UHFFFAOYSA-N
Molecular formula
C11H17NO
Average molar mass
179.26 g/mol
Monoisotopic mass
179.13101416

Names & identifiers

Preferred name
Tricyclo(3.3.1.13,7)decane-1-carboxamide
IUPAC
adamantane-1-carboxamide
English name
1-ADAMANTANECARBOXAMIDE
Molecular formula
C11H17NO
Molecular weight
179.26

Names & synonyms

1-ADAMANTANECARBOXAMIDE5511-18-2Tricyclo(3.3.1.13,7)decane-1-carboxamideDTXSID30203628RefChem:429050DTXCID60126119adamantane-1-carboxamideMFCD00077200adamantanecarboxamideBRN 2047887admantane-1-carboxamidetricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Show more names
OTAVA-BB BB5030040657SALOR-INT L496057-1EALABOTEST-BB LT00007835Adamantane Impurity 141-Adamantanecarboxamide,98%1-Adamantanecarboxamide >8-Quinolinol sulfate hydrate
STL290663CS-0149960EN300-17187119-Minocycline-d6 Disulfate SaltTricyclo(3.3.1.1(sup 3,7))decane-1-carboxamide1-Adamantyl-carboxamide1-adamantane carboxamideFT-0621897

Database identifiers

CAS
5511-18-2
PubChem CID
21686
DTXSID
DTXSID30203628
ChEMBL
CHEMBL2041315
EC Number
640-514-8
Nikkaji
J55.145G

Properties

Computed structural properties

XLogP
2
Topological polar surface area
43.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
13

Experimental & physicochemical properties

SpringerMaterials PropertiesBoiling point

Physicochemical properties

Melting point
188 · 188-190 °C(lit.)
Boiling point
311.8 °C · 311.8°C (rough estimate)
Density
1.002 · 1.0020 (rough estimate)
refractive index
1.5065 · 1.5065 (estimate)
storage temp.
Sealed in dry,Room Temperature
solubility
Chloroform, Dichloromethane, Methanol

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE
Eyeshields, Gloves, type N95 (US)
wgk
3
rtecs
AU4452000
hs_code
29242990
Signal word
Warning
Symbol(GHS)
GHS07

Chemistry & industry

Applications

UsesReproduction of Sindbis virus strains sensitive and resistant to 1-adamantanecarboxamide

Upstream & downstream products

Downstream products

Suppliers91 total

河北凡博医药科技有限公司15588346797
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]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

Related reactions

3 records
New reaction record

Compound notes

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