CAS 34701-33-2 1,2-Dimethylpropylamine, (R)- (HCID 6999786)

기본 정보

CAS: 34701-33-2
표준 SMILES: CC(C)[C@@H](C)N
InChIKey: JOZZAIIGWFLONA-RXMQYKEDSA-N
분자식: C5H13N
평균 분자량: 87.16 g/mol

이름 및 식별자

우선 이름: 1,2-Dimethylpropylamine, (R)-
IUPAC: (2R)-3-methylbutan-2-amine
현지명: (R)-(-)-2-아미노-3-메틸부탄
영어명: (R)-(-)-2-Amino-3-methylbutane
분자식: C5H13N
분자량: 87.16

이름 및 동의어

34701-33-2(R)-(-)-2-Amino-3-methylbutane(R)-3-methyl-2-butylamine(R)-3-methylbutan-2-amine(R)-(-)-3-Methyl-2-butylamineS9YGL88QKQ(-)-3-Methylbutan-2-amine(R)-2-Amino-3-methylbutaneL-(-)-2-Amino-3-methylbutane2-Butanamine, 3-methyl-, (2R)-J1.251.143D1,2-DIMETHYLPROPYLAMINE, (R)-

이름 더 보기

(R)-(-)-2-아미노-3-메틸부탄(2R)-3-METHYLBUT-2-YLAMINE(R)-(+)-3-METHYL-2-BUTYLAMINE2-ButanaMine,3-Methyl-, (2R)-(R)-(+)-2-AMINO-3-METHYLBUTANE(R)-(?)-2-Amino-3-methylbutane(R)-(-)-3-Methyl-2-butylamine, ChiPros

3-METHYL-2-BUTYLAMINE, (2R)-RefChem:411795628-450-9(2R)-3-methylbutan-2-amine(R)-1,2-dimethylpropylamineUNII-S9YGL88QKQMFCD010757312-Butanamine, 3-methyl-, (R)-

데이터베이스 식별자

CAS: 34701-33-2
PubChem CID: 6999786
UNII: S9YGL88QKQ
EC Number: 628-450-9
Nikkaji: J1.251.143D

물성

구조 계산 물성

XLogP: 1
극성 표면적: 26 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 1
무거운 원자 수: 6
형식 전하: 0
복잡도: 32.9

물리화학적 성질

끓는 점: 85 · 85-87°C
밀도: 0.75 g/mL · 0.75 g/mL at 20 °C(lit.)
굴절률: 1.406 · 1.4060
인화점: 21 °C · <21°C
산도 계수 (pKa): 10.8 · 10.80±0.10(Predicted)
물리적 상태: liquid
수용성: 물에 용해됩니다(20°C에서 60g/L).
BRN: 1718798 · 1718798
InChI: 1S/C5H13N/c1-4(2)5(3)6/h4-5H,6H2,1-3H3/t5-/m1/s1
InChIKey: JOZZAIIGWFLONA-RXMQYKEDSA-N
SMILES: CC(C)[C@@H](C)N

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 147 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesFlam. Liq. 2 (100%)

안전 데이터

wgk: 3
rtecs: UI1100000
ridadr: UN 2733 3/PG 2
risk_code: 11-22-34
hazard_code: F,C
safety_code: 26-36/37/39-45
포장분류: II
위험 등급: 3
F 고인화성물질: 10-34
Hazard Classifications: Acute Tox. 3 InhalationAcute Tox. 4 OralFlam. Liq. 2Skin Corr. 1B
스토리지 클래스: 3 - Flammable liquids