Structure

Histamine

CAS
51-45-6
Catalog Number
ACM51456
Category
Other Products
Molecular Weight
111.15
Molecular Formula
C5H9N3

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Specification

Synonyms
4-(2-Aminoethyl)-imidazol
IUPAC Name
2-(1H-imidazol-5-yl)ethanamine
Canonical SMILES
C1=C(NC=N1)CCN
InChI
InChI=1S/C5H9N3/c6-2-1-5-3-7-4-8-5/h3-4H,1-2,6H2,(H,7,8)
InChI Key
NTYJJOPFIAHURM-UHFFFAOYSA-N
Boiling Point
167 °C /0.8mmHg (lit.)
Melting Point
83-84 °C (lit.)
Density
0.99 g/ml
Appearance
White to light yellow solid
Hazard Statements
Xn
pKa
6.04
Safety Description
22-26-36/37
Solubility In Water
Soluble
Supplemental Hazard Statements
H301-H315-H317-H319-H334-H335
Symbol
GHS06,GHS08
What is the PubChem CID of histamine?

The PubChem CID of histamine is 774.

What is the molecular formula of histamine?

The molecular formula of histamine is C5H9N3.

What is the molecular weight of histamine?

The molecular weight of histamine is 111.15 g/mol.

What is the IUPAC Name of histamine?

The IUPAC Name of histamine is 2-(1H-imidazol-5-yl)ethanamine.

What is the InChIKey of histamine?

The InChIKey of histamine is NTYJJOPFIAHURM-UHFFFAOYSA-N.

What is the canonical SMILES of histamine?

The canonical SMILES of histamine is C1=C(NC=N1)CCN.

What is the CAS number of histamine?

The CAS number of histamine is 51-45-6.

What is the UNII of histamine?

The UNII of histamine is 820484N8I3.

What is the ChEMBL ID of histamine?

The ChEMBL ID of histamine is CHEMBL90.

What is the Wikipedia page for histamine?

The Wikipedia page for histamine is Histamine.

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