2-Aminopyrimidine

CAT: 0127-OR5847-01Size: 100 gDry Ice: NoHazardous: No

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CAT#:0127-OR5847-01Size:100 g

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CAS Number

109-12-6

Synonyms

Pyrimidin-2-amine

MDL Number

MFCD00006089

Purity

97%

Smiles

Nc1ncccn1

Chemical Information

2-Aminopyrimidine

Pyrimidin-2-amine is an aminopyrimidine carrying an amino group at position 2.

CAS Number	109-12-6
PubChem CID	7978
IUPAC Name	pyrimidin-2-amine
Molecular Formula	C4H5N3
Molecular Weight	95.10
XLogP	-0.2
Topological Polar Surface Area	51.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	7
Formal Charge	0
Complexity	48

SMILES

C1=CN=C(N=C1)N

InChI

InChI=1S/C4H5N3/c5-4-6-2-1-3-7-4/h1-3H,(H2,5,6,7)

InChIKey

LJXQPZWIHJMPQQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 109-12-6

CID: 7978

Formula: C4H5N3

MW: 95.10

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	95.10
XLogP3	-0.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	95.048347172
Monoisotopic Mass	95.048347172
Topological Polar Surface Area	51.8 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	48.9
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

Catalog	Name
OR1046332-01	5-Aminopyrimidine-2-carboxamide
OR74280-01	5-Aminopyrimidine-2-carbonitrile
OR302417	4-Aminopyrimidine-2-carbonitrile
OR1193T-01	4-Aminopyrimidine-2-thiol
OR30751-01	5-Aminopyrimidine
OR8287-01	4-Aminopyrimidine
OR1005781-01	6-Aminopyrimidine-2 (1H) -thione
OR78733-01	4-Aminopyrimidine-2-carboxylic acid
OR1022236	Methyl 5-aminopyrimidine-2-carboxylate
OR76198-01	Ethyl 4-aminopyrimidine-2-carboxylate

Catalog	Name
HY-41340-01	2-Aminopyrimidine
abx183083-01	2-Aminopyrimidine hydrochloride
HY-W720946	2-Aminopyrimidine-d2
00171 00100	2-Aminopyrimidine For Synthesis
HY-41340R-01	2-Aminopyrimidine (Standard)
sc-259757A	2-Chloro-5-aminopyrimidine
sc-298274	2-Aminopyrimidine-5-carbaldehyde
sc-207005	5-Bromo-2-aminopyrimidine
VJA32146-01	4-Aminopyrimidine-2-carbonitrile
abx180290-01	2-Aminopyrimidine-5-carbonitrile