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887353-35-7 | 12-(t-Boc-amino)-1-dodecyl Bromide
CAS No: 887353-35-7 Catalog No: AG00467V MDL No:
Product Description
Catalog Number:
AG00467V
Chemical Name:
12-(t-Boc-amino)-1-dodecyl Bromide
CAS Number:
887353-35-7
Molecular Formula:
C17H34BrNO2
Molecular Weight:
364.3614
IUPAC Name:
tert-butyl N-(12-bromododecyl)carbamate
InChI:
InChI=1S/C17H34BrNO2/c1-17(2,3)21-16(20)19-15-13-11-9-7-5-4-6-8-10-12-14-18/h4-15H2,1-3H3,(H,19,20)
InChI Key:
NMEYVOTVGMXGKU-UHFFFAOYSA-N
SMILES:
BrCCCCCCCCCCCCNC(=O)OC(C)(C)C
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
363.177g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
364.368g/mol
Monoisotopic Mass:
363.177g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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