Histamine 97%

CAT: 0286-H06860-02Size: 5 gDry Ice: NoHazardous: Yes

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CAT#:0286-H06860-02Size:5 g

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CAS Number

51-45-6

Synonyms

2- (4-Imidazolyl) ethylamine

UN Code

UN2811

Pictogram

06 - Acute Toxicity

UDF Signal Word

Danger

MDL Number

MFCD00005210

Hazard Statement

H301 Toxic if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.

DOT Name

Toxic Solids, Organic, N.O.S.

DOT Classification

Class 6.1

Packaging Group

PGIII

Precautions

P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P310 IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P342+P311 IF experiencing respiratory symptoms: call a POISON CENTER or doctor/physician.

Chemical Information

Histamine

Histamine is a member of the class of imidazoles that is 1H-imidazole substituted at position C-4 by a 2-aminoethyl group. It has a role as a neurotransmitter, a mouse metabolite and a human metabolite. It is a member of imidazoles and an aralkylamino compound. It is a conjugate base of a histaminium.

CAS Number	51-45-6
PubChem CID	774
IUPAC Name	2-(1H-imidazol-5-yl)ethanamine
Molecular Formula	C5H9N3
Molecular Weight	111.15
XLogP	-0.7
Topological Polar Surface Area	54.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	8
Formal Charge	0
Complexity	64

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)

InChIKey

NTYJJOPFIAHURM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 51-45-6

CID: 774

Formula: C5H9N3

MW: 111.15

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	111.15
XLogP3	-0.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	111.079647300
Monoisotopic Mass	111.079647300
Topological Polar Surface Area	54.7 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	64.7
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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44043000-2	Histamine

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