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N-(5-(Acetylamino)pentylene)acetamide

HCID 100784
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
3073-58-3
Standard SMILES
CC(=O)NCCCCCNC(C)=O
InChIKey
FQKKPLXFGDCBJT-UHFFFAOYSA-N
Molecular formula
C9H18N2O2
Average molar mass
186.25 g/mol
Monoisotopic mass
186.13682782

Overview

N-(5-Acetamidopentyl)acetamide is a member of acetamides.

Names & identifiers

Preferred name
N-(5-(Acetylamino)pentylene)acetamide
IUPAC
N-(5-acetamidopentyl)acetamide
English name
bis-(acetyl)diaminopentane
Molecular formula
C9H18N2O2
Molecular weight
186.25

Names & synonyms

N-(5-acetamidopentyl)acetamide3073-58-3Acetamide, N,N'-1,5-pentanediylbis-Bis-(acetyl)diaminopentaneAQW6DV59QENSC-366754RefChem:828024N-(5-(Acetylamino)pentylene)acetamide827-928-6pentamethylene bisacetamideN,N'-(pentane-1,5-diyl)diacetamide146695-99-0
Show more names
NSC366754starbld0043259orb1991031SCHEMBL1846096SCHEMBL5466428SCHEMBL8323964CHEMBL3120730DTXSID40952958

Database identifiers

CAS
3073-58-3
PubChem CID
100784
DTXSID
DTXSID40952958
ChEMBL
CHEMBL3120730
ChEBI
CHEBI:181585
UNII
AQW6DV59QE
EC Number
827-928-6
Nikkaji
J940.719G

Properties

Computed structural properties

XLogP
-0.1
Topological polar surface area
58.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
6
Heavy atoms
13
Formal charge
0
Complexity
151

Physicochemical properties

Boiling point
451.7 · 451.7±28.0 °C(Predicted)
Density
0.985 · 0.985±0.06 g/cm3(Predicted)
pka
16.18 · 16.18±0.46(Predicted)
FDA UNII
6 DV59QE · AQW6DV59QE
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
335 · H335-H302-H315-H319
Precautionary statements
264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H335-H302-H315-H319
Precautionary statements
P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P

Chemistry & industry

Suppliers1 total

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

Additional notes

DefinitionChEBI: N-(5-Acetamidopentyl)acetamide is a member of acetamides.

Related reactions

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Compound notes

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