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1-(Dimethylamino)pyrrole

HCID 573527
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
78307-76-3
Standard SMILES
CN(C)n1cccc1
InChIKey
ZOORJGVSPXCZCJ-UHFFFAOYSA-N
Molecular formula
C6H10N2
Average molar mass
110.16 g/mol
Monoisotopic mass
110.08439832

Names & identifiers

Preferred name
1-(Dimethylamino)pyrrole
IUPAC
N,N-dimethylpyrrol-1-amine
English name
1-(DIMETHYLAMINO)PYRROLE
Molecular formula
C6H10N2
Molecular weight
110.16

Names & synonyms

1-(Dimethylamino)pyrrole78307-76-3DTXSID00341506RefChem:427725DTXCID80292587628-801-6N,N-dimethylpyrrol-1-amineN,N-Dimethyl-1H-pyrrol-1-amineMFCD00010276N-dimethylaminopyrrole1-(dimethylamino)-pyrroleSCHEMBL2354989
Show more names
1-(Dimethylamino)pyrrole,99%1-(Dimethylamino)-1H-pyrrole1-(DIMETHYLAMINO)-PYRROLE 99%1H-Pyrrol-1-amine, N,N-dimethyl-
SCHEMBL47222321-(Dimethylamino)pyrrole, 99%ZOORJGVSPXCZCJ-UHFFFAOYSA-GEO-01154N,N-Dimethyl-1H-pyrrol-1-amine #AKOS005258258DB-075448InChI=1/C6H10N2/c1-7(2)8-5-3-4-6-8/h3-6H,1-2H3

Database identifiers

CAS
78307-76-3
PubChem CID
573527
DTXSID
DTXSID00341506
EC Number
628-801-6
Nikkaji
J150.051A

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
8.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
8
Formal charge
0
Complexity
64.9

Physicochemical properties

Melting point
52 °C · 52 °C
Boiling point
138 · 138-140 °C (lit.)
Density
0.912 g/mL · 0.912 g/mL at 25 °C (lit.)
refractive index
20 · n20/D 1.48(lit.)
Flash point
98 °F · 98 °F
storage temp.
Flammables area
pka
-4.16 · -4.16±0.16(Predicted)
InChI
1S/C6H10N2/c1-7(2)8-5-3-4-6-8/h3-6H,1-2H3
InChIKey
ZOORJGVSPXCZCJ-UHFFFAOYSA-N
SMILES
CN(C)n1cccc1
CAS DataBase Reference
78307 · 78307-76-3
UNSPSC Code
12352100 · 12352100
NACRES
22 · NA.22
Symbol(GHS)
2 · GHS02,GHS07
Signal word
Warning
Hazard statements
226 · H226-H315-H319

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

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P264, P264+P265, P280, P302+P352, P303+P361+P353, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P235, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

Safety data

PPE
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
ridadr
UN 1993 3/PG 3
risk_code
10-36/38
Signal word
Warning
Symbol(GHS)
GHS02,GHS07
hazard_code
Xi
safety_code
16-26-36
hazard_class
3.2
Storage Class
3 - Flammable liquids
packing_group
III
Hazard statements
H226-H315-H319
Hazard Classifications
Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2
Precautionary statements
P305+P351+P338

Chemistry & industry

Applications

Uses1-(Dimethylamino)pyrrole is a pyrrole monomer and can be polymerized electrochemically or by using simple chemical polymerization methods to form electroactive polymers.

General Description1-(Dimethylamino)pyrrole is a pyrrole monomer and can be polymerized electrochemically or by using simple chemical polymerization methods to form electroactive polymers.

Suppliers10 total

江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
上海康曼生物科技有限公司18800375331 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Richest Group Ltd18017061086 · [email protected]
上海齐奥化工科技有限公司021-58892003 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]

Related reactions

3 records
New reaction record
HRID 689480 reaction equation
HRID 689480As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1432578 reaction equation
HRID 1432578As reactantuspto-grants-2009_11
HRID 1432702 reaction equation
HRID 1432702As reactantuspto-grants-2009_11

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Precautionary statements
305 · P305+P351+P338
PPE
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes
Xi
Risk Statements
10 · 10-36/38
Safety Statements
16 · 16-26-36
RIDADR
1993 · UN 1993 3/PG 3
WGK Germany
3 · 3
HazardClass
3.2 · 3.2
PackingGroup
III
Storage Class
3 · 3 - Flammable liquids
Hazard Classifications
2 Flam · Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2