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72135-46-7 | 2-Pyrrolidinemethanamine,1-(1-cyclohexen-1-ylmethyl)-
CAS No: 72135-46-7 Catalog No: AG005K4S MDL No:
Product Description
Catalog Number:
AG005K4S
Chemical Name:
2-Pyrrolidinemethanamine,1-(1-cyclohexen-1-ylmethyl)-
CAS Number:
72135-46-7
Molecular Formula:
C12H22N2
Molecular Weight:
194.3165
IUPAC Name:
[1-(cyclohexen-1-ylmethyl)pyrrolidin-2-yl]methanamine
InChI:
InChI=1S/C12H22N2/c13-9-12-7-4-8-14(12)10-11-5-2-1-3-6-11/h5,12H,1-4,6-10,13H2
InChI Key:
PUVRPONDSAVLJE-UHFFFAOYSA-N
SMILES:
NCC1CCCN1CC1=CCCCC1
EC Number:
276-356-8
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.178g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.322g/mol
Monoisotopic Mass:
194.178g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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