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2-benzyl-6-nitro-1,2,3,4-tetrahydroisoquinoline

2-benzyl-6-nitro-1,2,3,4-tetrahydroisoquinoline structure

CAS No:
208589-95-1
Formula:
C16H16N2O2
Chemical Name:
2-benzyl-6-nitro-1,2,3,4-tetrahydroisoquinoline
Synonyms:
2-benzyl-6-nitro-1,2,3,4-tetrahydroisoquinoline;Isoquinoline, 1,2,3,4-tetrahydro-6-nitro-2-(phenylmethyl)-;2-Benzyl-6-nitro-1,2,3,4-tetrahydro-isoquinoline;SCHEMBL6296037;DTXSID60624105;ACT09223;CS-M0239;KS-00001E2C;3160AH;ZINC72265959

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2-benzyl-6-nitro-1,2,3,4-tetrahydroisoquinoline Basic Attributes

Molecular Weight：

268.31044

Exact Mass：

268.12100

DSSTox ID：

DTXSID60624105

HScode：

2933499090

Characteristics

PSA：

49.1

XLogP3：

3.61420

Density：

1.233±0.06 g/cm3(Predicted)

Computed Properties

Molecular Weight:268.31
XLogP3:3.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:268.121177757
Monoisotopic Mass:268.121177757
Topological Polar Surface Area:49.1
Heavy Atom Count:20
Complexity:336
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-benzyl-6-nitro-1,2,3,4-tetrahydroisoquinoline

Basic Attributes
Characteristics
Computed Properties

2-benzyl-6-nitro-1,2,3,4-tetrahydroisoquinoline

SDS

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