CAS 91271-84-0 [4-(Morpholin-4-ylmethyl)phenyl]methanamine (HCID 2795501)

基本情報

CAS: 91271-84-0
標準SMILES: NCc1ccc(CN2CCOCC2)cc1
InChIKey: OTMQHFNPBREFIL-UHFFFAOYSA-N
分子式: C12H18N2O
平均分子量: 206.28 g/mol
単同位体質量: 206.1419132

名称と識別子

優先名称: [4-(Morpholin-4-ylmethyl)phenyl]methanamine
IUPAC: [4-(morpholin-4-ylmethyl)phenyl]methanamine
現地名: 4-(モルホリノメチル)ベンジルアミン
英語名: 4-(MORPHOLINOMETHYL)BENZYLAMINE
分子式: C12H18N2O
分子量: 206.28

名称と別名

[4-(morpholin-4-ylmethyl)phenyl]methanamine(4-(morpholin-4-ylmethyl)phenyl)methanamineRefChem:402270837-903-191271-84-0(4-(Morpholinomethyl)phenyl)methanamine4-morpholin-4-ylmethylbenzylamine4-(morpholinomethyl)benzylamine4-Morpholin-4-ylmethyl-benzylamine1-[4-(morpholin-4-ylmethyl)phenyl]methanamineMFCD056644104-[4-(Aminomethyl)benzyl]morpholine

名称をさらに表示

4-(モルホリノメチル)ベンジルアミン4‐(モルホリノメチル)ベンジルアミン1-{4-[(モルホリン-4-イル)メチル]フェニル}メタンアミンAKOS BB-8919BUTTPARK 98\57-94AKOS BBS-00002727TIMTEC-BB SBB0111514-Morpholino-4ylmethylbenzylamine4-(4-MORPHOLINYLMETHYL)BENZYLAMINE-(Morpholin-4-ylmethyl)benzylamine

1-{4-[(Morpholin-4-yl)methyl]phenyl}methanamine4-Morpholino-4ylmethylbenzyl amine4-(morpholin-4-ylmethyl)benzylamine{4-[(morpholin-4-yl)methyl]phenyl}methanamine[4-(morpholinomethyl)phenyl]methanamine[4-(morpholin-4-ylmethyl)phenyl]methylamineBenzenemethanamine,4-(4-morpholinylmethyl)-SCHEMBL113089

データベース識別子

CAS: 91271-84-0
PubChem CID: 2795501
DTXSID: DTXSID20383721
EC Number: 837-903-1
Nikkaji: J2.258.463D

物性

構造計算による物性

XLogP: 0.4
極性表面積: 38.5 Å²
水素結合供与体数: 1
水素結合受容体数: 3
回転可能結合数: 3
重原子数: 15
形式電荷: 0
複雑度: 172

物理化学的性質

融点: 54 · 54-56°C
沸点: 324.7 · 324.7±32.0 °C(Predicted)
比重(密度): 1.103 · 1.103±0.06 g/cm3(Predicted)
貯蔵温度: 2 · 2-8°C(protect from light)
酸解離定数(Pka): 9.18 · 9.18±0.10(Predicted)
CAS データベース: 91271 · 91271-84-0

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)

安全データ

hs_code: 2934999090
risk_code: 36/37/38
hazard_code: C
hazard_note: Corrosive
safety_code: 26-36/37/39
hazard_class: IRRITANT

化学と産業

上流・下流製品情報

上流原料

Carbamic acid, N-[[4-(4-morpholinylmethyl)phenyl]methyl]-, 1,1-dimethylethyl ester 4-(モルホリノメチル)ベンゾニトリルテトラヒドロフラン水素化リチウムアルミニウム水和物

サプライヤー48 社

上海康恩博医药科技有限公司17510465506 · [email protected]

韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

Sichuan Biosynce Pharmatech Co., Ltd.[email protected]

上海瀚麟生物科技有限公司183-0212-4410 18302124410 · [email protected]

化合物ノート

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