CAS: 625437-34-5
名称: N-[(6-chloro-1,3-benzodioxol-5-yl)methyl]cyclopropanamine
SMILES:
C1CC1NCC2=CC3=C(C=C2Cl)OCO3Molecular Processing
Molecular formula
C11H12ClNO2
Molecular weight
225.67
Exact mass
225.0557
XLogP
2.32
TPSA
30.49
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
15
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
57.44
Supplementary Information
InChIKey: VRDMJNOXKZMLTF-UHFFFAOYSA-N
同義語
(6-Chlorobenzo[1,3]dioxol-5-ylmethyl)cyclopropylamine625437-34-5N-[(6-chloro-1,3-dioxaindan-5-yl)methyl]cyclopropanamineSCHEMBL2467073VRDMJNOXKZMLTF-UHFFFAOYSA-NDB-327869EN300-372513
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