Home Other Building Blocks Carbamic acid, (1,1-dimethylethyl)-, methyl ester

Carbamic acid, (1,1-dimethylethyl)-, methyl ester

CAS No.:
27701-01-5
Catalog Number:
AG01DTQB
Molecular Formula:
C6H13NO2
Molecular Weight:
131.1729
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Product Description
Catalog Number:
AG01DTQB
Chemical Name:
Carbamic acid, (1,1-dimethylethyl)-, methyl ester
CAS Number:
27701-01-5
Molecular Formula:
C6H13NO2
Molecular Weight:
131.1729
MDL Number:
MFCD01325752
IUPAC Name:
methyl N-tert-butylcarbamate
InChI:
InChI=1S/C6H13NO2/c1-6(2,3)7-5(8)9-4/h1-4H3,(H,7,8)
InChI Key:
HBCAQUUDOCPMTB-UHFFFAOYSA-N
SMILES:
COC(=O)NC(C)(C)C
Properties
Complexity:
104  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
131.095g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
131.175g/mol
Monoisotopic Mass:
131.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties