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1000018-27-8 | tert-Butyl 3-Chloropropyl(cyclopropyl)carbamate
CAS No: 1000018-27-8 Catalog No: AG01F9OY MDL No:
Product Description
Catalog Number:
AG01F9OY
Chemical Name:
tert-Butyl 3-Chloropropyl(cyclopropyl)carbamate
CAS Number:
1000018-27-8
Molecular Formula:
C11H20ClNO2
Molecular Weight:
233.7350
IUPAC Name:
tert-butyl N-(3-chloropropyl)-N-cyclopropylcarbamate
InChI:
InChI=1S/C11H20ClNO2/c1-11(2,3)15-10(14)13(8-4-7-12)9-5-6-9/h9H,4-8H2,1-3H3
InChI Key:
KHYSGMWIIYMWJY-UHFFFAOYSA-N
SMILES:
ClCCCN(C(=O)OC(C)(C)C)C1CC1
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.118g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.736g/mol
Monoisotopic Mass:
233.118g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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