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874823-37-7 | tert-Butyl (trans-4-(aminomethyl)cyclohexyl)carbamate hydrochloride
CAS No: 874823-37-7 Catalog No: AG004FMQ MDL No:MFCD04112679
Product Description
Catalog Number:
AG004FMQ
Chemical Name:
tert-Butyl (trans-4-(aminomethyl)cyclohexyl)carbamate hydrochloride
CAS Number:
874823-37-7
Molecular Formula:
C12H25ClN2O2
Molecular Weight:
264.7921
MDL Number:
MFCD04112679
IUPAC Name:
tert-butyl N-[4-(aminomethyl)cyclohexyl]carbamate;hydrochloride
InChI:
InChI=1S/C12H24N2O2.ClH/c1-12(2,3)16-11(15)14-10-6-4-9(8-13)5-7-10;/h9-10H,4-8,13H2,1-3H3,(H,14,15);1H
InChI Key:
VVIUAQDJHBEGEE-UHFFFAOYSA-N
SMILES:
NC[C@@H]1CC[C@H](CC1)NC(=O)OC(C)(C)C.Cl
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.16g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
264.794g/mol
Monoisotopic Mass:
264.16g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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