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(cyclobutylmethyl)thiourea

CAS No.:
1095505-12-6
Catalog Number:
AG019XAT
Molecular Formula:
C6H12N2S
Molecular Weight:
144.2379
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Product Description
Catalog Number:
AG019XAT
Chemical Name:
(cyclobutylmethyl)thiourea
CAS Number:
1095505-12-6
Molecular Formula:
C6H12N2S
Molecular Weight:
144.2379
MDL Number:
MFCD11634958
IUPAC Name:
cyclobutylmethylthiourea
InChI:
InChI=1S/C6H12N2S/c7-6(9)8-4-5-2-1-3-5/h5H,1-4H2,(H3,7,8,9)
InChI Key:
PPCXHDOVGOVRBQ-UHFFFAOYSA-N
SMILES:
NC(=S)NCC1CCC1
Properties
Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.072g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
144.236g/mol
Monoisotopic Mass:
144.072g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties