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147252-84-4 | Carbamic acid, N-(2-hydroxy-1-methylethyl)-, 1,1-dimethylethyl ester
CAS No: 147252-84-4 Catalog No: AG001EQS MDL No:MFCD04973335
Product Description
Catalog Number:
AG001EQS
Chemical Name:
Carbamic acid, N-(2-hydroxy-1-methylethyl)-, 1,1-dimethylethyl ester
CAS Number:
147252-84-4
Molecular Formula:
C8H17NO3
Molecular Weight:
175.2255
MDL Number:
MFCD04973335
IUPAC Name:
tert-butyl N-(1-hydroxypropan-2-yl)carbamate
InChI:
InChI=1S/C8H17NO3/c1-6(5-10)9-7(11)12-8(2,3)4/h6,10H,5H2,1-4H3,(H,9,11)
InChI Key:
PDAFIZPRSXHMCO-UHFFFAOYSA-N
SMILES:
OCC(NC(=O)OC(C)(C)C)C
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.121g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
175.228g/mol
Monoisotopic Mass:
175.121g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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