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NSC45356

NSC45356 structure

CAS No:
3775-60-8
Formula:
C2H3N3O
Chemical Name:
NSC45356
Synonyms:
NSC45356;1,3,4-oxadiazol-2-amine;2-Amino-1,3,4-oxadiazole
Categories:
Pharmaceutical Intermediates > Ophthalmic Agents

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NSC45356 Basic Attributes

Molecular Weight：

85.06

Exact Mass：

85.027611728 g/mol

NSC Number：

45356

DSSTox ID：

DTXSID70286394

Characteristics

PSA：

64.9 Å²

XLogP3：

-1.44 (LogP)

Density：

1.395±0.06 g/cm3

Melting Point：

156 °C

Boiling Point：

205.6±23.0 °C(Predicted)

PKA：

-0.75±0.10

Safety Information

GHS Classification：

|Danger|H314 (66.67%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P261, P264, P271, P280, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 3 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

2-amino-1,3,4-oxadiazole

Computed Properties

Molecular Weight:85.07
XLogP3:-1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Exact Mass:85.027611728
Monoisotopic Mass:85.027611728
Topological Polar Surface Area:64.9
Heavy Atom Count:6
Complexity:48.1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 3775-60-8

Grade: Pharmaceutical Grade

Content: 99%

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