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16486-66-1 | Carbamic chloride, (1,1-dimethylethyl)(phenylmethyl)- (9CI)
CAS No: 16486-66-1 Catalog No: AG001V46 MDL No:
Product Description
Catalog Number:
AG001V46
Chemical Name:
Carbamic chloride, (1,1-dimethylethyl)(phenylmethyl)- (9CI)
CAS Number:
16486-66-1
Molecular Formula:
C12H16ClNO
Molecular Weight:
225.7145
IUPAC Name:
N-benzyl-N-tert-butylcarbamoyl chloride
InChI:
InChI=1S/C12H16ClNO/c1-12(2,3)14(11(13)15)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
InChI Key:
QJVVLPQDINHXAT-UHFFFAOYSA-N
SMILES:
ClC(=O)N(C(C)(C)C)Cc1ccccc1
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.092g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.716g/mol
Monoisotopic Mass:
225.092g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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