Tìm theo
Cyanamide
Thuốc Gốc
Small Molecule
CAS: 420-04-2
CTHH: CH2N2
PTK: 42.04
A cyanide compound which has been used as a fertilizer, defoliant and in many manufacturing processes. It often occurs as the calcium salt, sometimes also referred to as cyanamide. The citrated calcium salt is used in the treatment of alcoholism. [PubChem]
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
CH2N2
Phân tử khối
42.04
Monoisotopic mass
42.021798074
InChI
InChI=1S/CH2N2/c2-1-3/h2H2
InChI Key
InChIKey=XZMCDFZZKTWFGF-UHFFFAOYSA-N
IUPAC Name
aminoformonitrile
Traditional IUPAC Name
cyanamide
SMILES
NC#N
Độ tan chảy
44 °C
Độ sôi
83 °C at 5.00E-01 mm Hg
Độ hòa tan
5E+005 mg/L (at 25 °C)
logP
-0.82
logS
-0.19
pKa (strongest acidic)
10.87
PSA
49.81 Å2
Refractivity
10.88 m3·mol-1
Polarizability
3.68 Å3
Rotatable Bond Count
0
H Bond Acceptor Count
2
H Bond Donor Count
1
Physiological Charge
0
Number of Rings
0
Bioavailability
1
Rule of Five
true
pKa
1.03 (at 25 °C)
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB02679
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=9864
PubChem Substance
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=46506862
KEGG Compound
http://www.genome.jp/dbget-bin/www_bget?cpd:C01566
KEGG Drug
http://www.genome.jp/dbget-bin/www_bget?drug:D00123
ChemSpider
http://www.chemspider.com/Chemical-Structure.9480.html
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