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251661-01-5 | Carbamic acid, N-(1-methylcyclopropyl)-, 1,1-dimethylethyl ester
CAS No: 251661-01-5 Catalog No: AG002QQ2 MDL No:MFCD11111233
Product Description
Catalog Number:
AG002QQ2
Chemical Name:
Carbamic acid, N-(1-methylcyclopropyl)-, 1,1-dimethylethyl ester
CAS Number:
251661-01-5
Molecular Formula:
C9H17NO2
Molecular Weight:
171.2368
MDL Number:
MFCD11111233
IUPAC Name:
tert-butyl N-(1-methylcyclopropyl)carbamate
InChI:
InChI=1S/C9H17NO2/c1-8(2,3)12-7(11)10-9(4)5-6-9/h5-6H2,1-4H3,(H,10,11)
InChI Key:
PJNBAQDPGDFJRG-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1(C)CC1
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.126g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.24g/mol
Monoisotopic Mass:
171.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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