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849065-22-1 | CYCLOHEXANOL, 2-AZIDO-1-METHYL-4-(1-METHYLETHENYL)-, (1R,2R,4S)-
CAS No: 849065-22-1 Catalog No: AG004VM4 MDL No:
Product Description
Catalog Number:
AG004VM4
Chemical Name:
CYCLOHEXANOL, 2-AZIDO-1-METHYL-4-(1-METHYLETHENYL)-, (1R,2R,4S)-
CAS Number:
849065-22-1
Molecular Formula:
C10H17N3O
Molecular Weight:
195.2615
IUPAC Name:
(1R,2R,4S)-2-azido-1-methyl-4-prop-1-en-2-ylcyclohexan-1-ol
InChI:
InChI=1S/C10H17N3O/c1-7(2)8-4-5-10(3,14)9(6-8)12-13-11/h8-9,14H,1,4-6H2,2-3H3/t8-,9+,10+/m0/s1
InChI Key:
UGEWRSOZTNHWTB-IVZWLZJFSA-N
SMILES:
[N-]=[N+]=N[C@@H]1C[C@H](CC[C@@]1(C)O)C(=C)C
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
195.137g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.266g/mol
Monoisotopic Mass:
195.137g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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