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Home > Bromides > 1632296-32-2
1632296-32-2 | Carbamic acid, N-(2-bromophenyl)-, [(3S)-1-methyl-3-pyrrolidinyl]methyl ester
CAS No: 1632296-32-2 Catalog No: AG001TX8 MDL No:
Product Description
Catalog Number:
AG001TX8
Chemical Name:
Carbamic acid, N-(2-bromophenyl)-, [(3S)-1-methyl-3-pyrrolidinyl]methyl ester
CAS Number:
1632296-32-2
Molecular Formula:
C13H17BrN2O2
Molecular Weight:
313.1903
IUPAC Name:
[(3S)-1-methylpyrrolidin-3-yl]methyl N-(2-bromophenyl)carbamate
InChI:
InChI=1S/C13H17BrN2O2/c1-16-7-6-10(8-16)9-18-13(17)15-12-5-3-2-4-11(12)14/h2-5,10H,6-9H2,1H3,(H,15,17)/t10-/m0/s1
InChI Key:
JVFOKKDTUCBMBH-JTQLQIEISA-N
SMILES:
CN1CC[C@@H](C1)COC(=O)Nc1ccccc1Br
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
312.047g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
313.195g/mol
Monoisotopic Mass:
312.047g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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