Home Other Building Blocks 1-(isocyanatomethyl)-1-[(methylsulfanyl)methyl]cyclopropane

1-(isocyanatomethyl)-1-[(methylsulfanyl)methyl]cyclopropane

CAS No.:
1375473-85-0
Catalog Number:
AG019TNO
Molecular Formula:
C7H11NOS
Molecular Weight:
157.2333
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Product Description
Catalog Number:
AG019TNO
Chemical Name:
1-(isocyanatomethyl)-1-[(methylsulfanyl)methyl]cyclopropane
CAS Number:
1375473-85-0
Molecular Formula:
C7H11NOS
Molecular Weight:
157.2333
MDL Number:
MFCD21602697
IUPAC Name:
1-(isocyanatomethyl)-1-(methylsulfanylmethyl)cyclopropane
InChI:
InChI=1S/C7H11NOS/c1-10-5-7(2-3-7)4-8-6-9/h2-5H2,1H3
InChI Key:
HATPMUMFCXPTJL-UHFFFAOYSA-N
SMILES:
CSCC1(CC1)CN=C=O
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.056g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
157.231g/mol
Monoisotopic Mass:
157.056g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties