Azacycloundecan-2-one

HCID 70523CAS 1009-89-8
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C1CCCCCCCCCN1
InChIKey
WULPUQZASCZTPO-UHFFFAOYSA-N
Molecular formula
C10H19NO
Average molar mass
169.26 g/mol
Monoisotopic mass
169.14666423

Names & identifiers

Preferred name
Azacycloundecan-2-one
IUPAC
azacycloundecan-2-one
English name
azacycloundecan-2-one
Molecular formula
C10H19NO
Molecular weight
169.26

Names & synonyms

Azacycloundecan-2-one1009-89-8EINECS 213-772-0DTXSID60143568RefChem:115917DTXCID3066059213-772-01-Azacycloundecan-2-oneCaprinolactam10-caprinolactam2-azacycloundecanonestarbld0025567
Show more names
D8U4GZ4BV8SCHEMBL2368343SCHEMBL9415911SCHEMBL16261231BAA00989NS00042087EN300-1721295Z1509140506

Database identifiers

CAS
1009-89-8
PubChem CID
70523
DTXSID
DTXSID60143568
UNII
D8U4GZ4BV8
EC Number
213-772-0
Nikkaji
J217.126K

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
12

Experimental & physicochemical properties

SpringerMaterials PropertiesCrystal structure

Physicochemical properties

Melting point
128 · 128-130 °C
Boiling point
130 · 130-140 °C(Press: 2 Torr)
Density
0.901 · 0.901±0.06 g/cm3(Predicted)
pka
16.92 · 16.92±0.20(Predicted)
FDA UNII
8 U4GZ4BV8 · D8U4GZ4BV8
Symbol(GHS)
7 · GHS07

Safety & regulation

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers1 total

宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]

Related reactions

3 records
New reaction record

Linked notes

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