4-Amino-2-chloro-5-fluoropyrimidine - CAS 155-10-2

Catalog:	BB011084
Product Name:	4-Amino-2-chloro-5-fluoropyrimidine
CAS:	155-10-2
Synonyms:	2-chloro-5-fluoro-4-pyrimidinamine; 2-chloro-5-fluoropyrimidin-4-amine

Technical Data

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Computed Properties

IUPAC Name:	2-chloro-5-fluoropyrimidin-4-amine
Description:	4-Amino-2-chloro-5-fluoropyrimidine (CAS# 155-10-2) is a useful research chemical.
Molecular Weight:	147.54
Molecular Formula:	C4H3ClFN3
Canonical SMILES:	C1=C(C(=NC(=N1)Cl)N)F
InChI:	InChI=1S/C4H3ClFN3/c5-4-8-1-2(6)3(7)9-4/h1H,(H2,7,8,9)
InChI Key:	SLQAJWTZUXJPNY-UHFFFAOYSA-N
Boiling Point:	318.463 ℃ at 760 mmHg
Density:	1.564 g/cm³
MDL:	MFCD00057344
LogP:	1.43250

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GHS Hazard Statement:	H302 (92.68%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P312, P330, and P501
Signal Word:	Warning

Complexity:	102
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	146.9999530
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	146.9999530
Rotatable Bond Count:	0
Topological Polar Surface Area:	51.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.9