Home Other Building Blocks tert-butyl N-[carbamothioyl(cyclopropyl)methyl]carbamate

tert-butyl N-[carbamothioyl(cyclopropyl)methyl]carbamate

CAS No.:
1340466-61-6
Catalog Number:
AG01DVAA
Molecular Formula:
C10H18N2O2S
Molecular Weight:
230.3271
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Product Description
Catalog Number:
AG01DVAA
Chemical Name:
tert-butyl N-[carbamothioyl(cyclopropyl)methyl]carbamate
CAS Number:
1340466-61-6
Molecular Formula:
C10H18N2O2S
Molecular Weight:
230.3271
MDL Number:
MFCD20317561
IUPAC Name:
tert-butyl N-(2-amino-1-cyclopropyl-2-sulfanylideneethyl)carbamate
InChI:
InChI=1S/C10H18N2O2S/c1-10(2,3)14-9(13)12-7(8(11)15)6-4-5-6/h6-7H,4-5H2,1-3H3,(H2,11,15)(H,12,13)
InChI Key:
VXGCYMNFTAGKOZ-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC(C(=S)N)C1CC1
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.109g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
230.326g/mol
Monoisotopic Mass:
230.109g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
96.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties