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592-35-8 | Butyl carbamate
CAS No: 592-35-8 Catalog No: AG003SUP MDL No:MFCD00007967
Product Description
Catalog Number:
AG003SUP
Chemical Name:
Butyl carbamate
CAS Number:
592-35-8
Molecular Formula:
C5H11NO2
Molecular Weight:
117.1463
MDL Number:
MFCD00007967
IUPAC Name:
butyl carbamate
InChI:
InChI=1S/C5H11NO2/c1-2-3-4-8-5(6)7/h2-4H2,1H3,(H2,6,7)
InChI Key:
SKKTUOZKZKCGTB-UHFFFAOYSA-N
SMILES:
CCCCOC(=O)N
EC Number:
209-751-0
UNII:
MY8I82AJS5
NSC Number:
187
Properties
Complexity:
72.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
117.079g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
117.148g/mol
Monoisotopic Mass:
117.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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